Manganese in PDB 8f4k: Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
Enzymatic activity of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
All present enzymatic activity of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution:
1.10.3.9;
Protein crystallography data
The structure of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution, PDB code: 8f4k
was solved by
A.Bhowmick,
R.Hussein,
I.Bogacz,
P.S.Simon,
M.Ibrahim,
R.Chatterjee,
M.D.Doyle,
M.H.Cheah,
T.Fransson,
P.Chernev,
I.-S.Kim,
H.Makita,
M.Dasgupta,
C.J.Kaminsky,
M.Zhang,
J.Gatcke,
S.Haupt,
I.I.Nangca,
S.M.Keable,
O.Aydin,
K.Tono,
S.Owada,
L.B.Gee,
F.D.Fuller,
A.Batyuk,
R.Alonso-Mori,
J.M.Holton,
D.W.Paley,
N.W.Moriarty,
F.Mamedov,
P.D.Adams,
A.S.Brewster,
H.Dobbek,
N.K.Sauter,
U.Bergmann,
A.Zouni,
J.Messinger,
J.Kern,
J.Yano,
V.K.Yachandra,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
33.52 /
2.16
|
|
Space group
|
P 21 21 21
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
116.991,
221.755,
307.964,
90,
90,
90
|
|
R / Rfree (%)
|
18.5 /
24.1
|
Other elements in 8f4k:
The structure of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution also contains other interesting chemical elements:
Manganese Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
16;
Binding sites:
The binding sites of Manganese atom in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
(pdb code 8f4k). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 16 binding sites of Manganese where determined in the
Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution, PDB code: 8f4k:
Jump to Manganese binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Manganese binding site 1 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 1 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn601
b:29.9
occ:0.65
|
MN1
|
A:OEX601
|
0.0
|
29.9
|
0.7
|
|
MN1
|
A:OEY602
|
0.0
|
34.3
|
0.3
|
|
OE2
|
A:GLU189
|
1.8
|
30.2
|
0.7
|
|
O6
|
A:OEY602
|
1.8
|
38.9
|
0.3
|
|
O3
|
A:OEY602
|
1.9
|
38.9
|
0.3
|
|
O3
|
A:OEX601
|
1.9
|
36.5
|
0.7
|
|
O1
|
A:OEX601
|
1.9
|
31.5
|
0.7
|
|
O1
|
A:OEY602
|
2.0
|
32.5
|
0.3
|
|
NE2
|
A:HIS332
|
2.0
|
37.0
|
0.7
|
|
OE2
|
A:GLU189
|
2.0
|
37.6
|
0.3
|
|
OD2
|
A:ASP342
|
2.0
|
35.2
|
0.3
|
|
OD2
|
A:ASP342
|
2.0
|
35.8
|
0.7
|
|
NE2
|
A:HIS332
|
2.2
|
37.3
|
0.3
|
|
MN2
|
A:OEY602
|
2.8
|
36.1
|
0.3
|
|
O5
|
A:OEX601
|
2.8
|
32.1
|
0.7
|
|
MN2
|
A:OEX601
|
2.8
|
32.2
|
0.7
|
|
O5
|
A:OEY602
|
2.9
|
37.5
|
0.3
|
|
CE1
|
A:HIS332
|
2.9
|
33.5
|
0.7
|
|
CD
|
A:GLU189
|
2.9
|
30.4
|
0.7
|
|
CG
|
A:ASP342
|
3.0
|
37.3
|
0.7
|
|
CG
|
A:ASP342
|
3.0
|
37.6
|
0.3
|
|
CD2
|
A:HIS332
|
3.0
|
31.7
|
0.7
|
|
CD
|
A:GLU189
|
3.1
|
37.9
|
0.3
|
|
CD2
|
A:HIS332
|
3.1
|
36.1
|
0.3
|
|
CE1
|
A:HIS332
|
3.2
|
34.3
|
0.3
|
|
OD1
|
A:ASP342
|
3.2
|
34.1
|
0.7
|
|
OD1
|
A:ASP342
|
3.3
|
35.6
|
0.3
|
|
MN3
|
A:OEX601
|
3.3
|
31.1
|
0.7
|
|
MN3
|
A:OEY602
|
3.3
|
38.4
|
0.3
|
|
CA1
|
A:OEY602
|
3.4
|
40.0
|
0.3
|
|
CA1
|
A:OEX601
|
3.4
|
32.8
|
0.7
|
|
O2
|
A:OEX601
|
3.4
|
32.3
|
0.7
|
|
O2
|
A:OEY602
|
3.4
|
35.5
|
0.3
|
|
OE1
|
A:GLU189
|
3.5
|
35.2
|
0.3
|
|
OE1
|
A:GLU189
|
3.6
|
34.2
|
0.7
|
|
O
|
A:HOH706
|
3.7
|
32.7
|
1.0
|
|
NE2
|
A:HIS337
|
4.0
|
33.9
|
0.7
|
|
OE1
|
A:GLU333
|
4.0
|
38.0
|
0.3
|
|
ND1
|
A:HIS332
|
4.0
|
26.4
|
0.7
|
|
NE2
|
A:HIS337
|
4.0
|
36.4
|
0.3
|
|
CG
|
A:GLU189
|
4.1
|
30.1
|
0.7
|
|
CG
|
A:HIS332
|
4.1
|
30.0
|
0.7
|
|
OE1
|
A:GLU333
|
4.1
|
33.1
|
0.7
|
|
OE1
|
C:GLU354
|
4.2
|
33.7
|
0.7
|
|
CG
|
A:HIS332
|
4.3
|
37.5
|
0.3
|
|
ND1
|
A:HIS332
|
4.3
|
33.4
|
0.3
|
|
OE1
|
C:GLU354
|
4.3
|
35.4
|
0.3
|
|
OXT
|
A:ALA344
|
4.3
|
34.0
|
0.7
|
|
CB
|
A:ASP342
|
4.3
|
38.8
|
0.3
|
|
CG
|
A:GLU189
|
4.4
|
38.2
|
0.3
|
|
CB
|
A:ASP342
|
4.4
|
37.4
|
0.7
|
|
OXT
|
A:ALA344
|
4.4
|
37.1
|
0.3
|
|
CG1
|
A:VAL185
|
4.5
|
35.0
|
0.3
|
|
OE2
|
C:GLU354
|
4.5
|
42.1
|
0.3
|
|
CG1
|
A:VAL185
|
4.6
|
26.5
|
0.7
|
|
CD
|
A:GLU333
|
4.6
|
35.0
|
0.7
|
|
O
|
A:HOH797
|
4.7
|
37.4
|
0.3
|
|
OE2
|
C:GLU354
|
4.7
|
35.0
|
0.7
|
|
O
|
A:ALA344
|
4.7
|
36.2
|
0.7
|
|
O
|
A:HOH806
|
4.7
|
37.8
|
0.6
|
|
CE1
|
A:HIS337
|
4.8
|
36.6
|
0.3
|
|
O
|
A:HOH797
|
4.8
|
33.0
|
0.7
|
|
O
|
A:ALA344
|
4.8
|
37.0
|
0.3
|
|
CE1
|
A:HIS337
|
4.8
|
32.7
|
0.7
|
|
CD
|
A:GLU333
|
4.8
|
37.2
|
0.3
|
|
CD
|
C:GLU354
|
4.8
|
39.1
|
0.3
|
|
CD
|
C:GLU354
|
4.9
|
35.6
|
0.7
|
|
C
|
A:ALA344
|
4.9
|
35.4
|
0.7
|
|
C
|
A:ALA344
|
4.9
|
36.6
|
0.3
|
|
OE2
|
A:GLU333
|
4.9
|
30.9
|
0.7
|
|
CD2
|
A:HIS337
|
4.9
|
32.0
|
0.7
|
|
Manganese binding site 2 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 2 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn601
b:32.2
occ:0.65
|
MN2
|
A:OEX601
|
0.0
|
32.2
|
0.7
|
|
MN2
|
A:OEY602
|
0.1
|
36.1
|
0.3
|
|
O1
|
A:OEX601
|
1.8
|
31.5
|
0.7
|
|
O1
|
A:OEY602
|
1.8
|
32.5
|
0.3
|
|
OE1
|
C:GLU354
|
1.9
|
35.4
|
0.3
|
|
OXT
|
A:ALA344
|
1.9
|
34.0
|
0.7
|
|
O2
|
A:OEX601
|
1.9
|
32.3
|
0.7
|
|
O3
|
A:OEX601
|
1.9
|
36.5
|
0.7
|
|
O3
|
A:OEY602
|
1.9
|
38.9
|
0.3
|
|
OE1
|
C:GLU354
|
1.9
|
33.7
|
0.7
|
|
O2
|
A:OEY602
|
1.9
|
35.5
|
0.3
|
|
OD1
|
A:ASP342
|
2.0
|
35.6
|
0.3
|
|
OXT
|
A:ALA344
|
2.0
|
37.1
|
0.3
|
|
OD1
|
A:ASP342
|
2.0
|
34.1
|
0.7
|
|
MN1
|
A:OEX601
|
2.8
|
29.9
|
0.7
|
|
MN1
|
A:OEY602
|
2.8
|
34.3
|
0.3
|
|
CG
|
A:ASP342
|
2.8
|
37.6
|
0.3
|
|
CD
|
C:GLU354
|
2.9
|
35.6
|
0.7
|
|
CD
|
C:GLU354
|
2.9
|
39.1
|
0.3
|
|
C
|
A:ALA344
|
2.9
|
35.4
|
0.7
|
|
MN3
|
A:OEX601
|
2.9
|
31.1
|
0.7
|
|
CG
|
A:ASP342
|
2.9
|
37.3
|
0.7
|
|
C
|
A:ALA344
|
2.9
|
36.6
|
0.3
|
|
MN3
|
A:OEY602
|
2.9
|
38.4
|
0.3
|
|
OD2
|
A:ASP342
|
3.0
|
35.2
|
0.3
|
|
OE2
|
C:GLU354
|
3.1
|
35.0
|
0.7
|
|
OD2
|
A:ASP342
|
3.2
|
35.8
|
0.7
|
|
OE2
|
C:GLU354
|
3.2
|
42.1
|
0.3
|
|
O
|
A:ALA344
|
3.2
|
36.2
|
0.7
|
|
O
|
A:ALA344
|
3.3
|
37.0
|
0.3
|
|
CA1
|
A:OEY602
|
3.4
|
40.0
|
0.3
|
|
CA1
|
A:OEX601
|
3.4
|
32.8
|
0.7
|
|
O
|
A:HOH706
|
3.7
|
32.7
|
1.0
|
|
O5
|
A:OEX601
|
3.8
|
32.1
|
0.7
|
|
O5
|
A:OEY602
|
3.8
|
37.5
|
0.3
|
|
O
|
A:HOH787
|
3.9
|
42.1
|
1.0
|
|
O6
|
A:OEY602
|
3.9
|
38.9
|
0.3
|
|
NE2
|
A:HIS337
|
4.0
|
33.9
|
0.7
|
|
NE2
|
A:HIS337
|
4.0
|
36.4
|
0.3
|
|
OE2
|
A:GLU189
|
4.1
|
37.6
|
0.3
|
|
OE2
|
A:GLU189
|
4.2
|
30.2
|
0.7
|
|
CA
|
A:ALA344
|
4.2
|
38.4
|
0.3
|
|
CA
|
A:ALA344
|
4.2
|
31.6
|
0.7
|
|
N
|
A:ALA344
|
4.2
|
39.8
|
0.3
|
|
CG
|
C:GLU354
|
4.2
|
41.4
|
0.3
|
|
CG
|
C:GLU354
|
4.2
|
32.5
|
0.7
|
|
CB
|
A:ASP342
|
4.3
|
38.8
|
0.3
|
|
N
|
A:ALA344
|
4.3
|
36.3
|
0.7
|
|
OE1
|
A:GLU333
|
4.3
|
33.1
|
0.7
|
|
CD2
|
A:HIS337
|
4.3
|
32.0
|
0.7
|
|
CB
|
A:ASP342
|
4.3
|
37.4
|
0.7
|
|
NE2
|
A:HIS332
|
4.4
|
37.0
|
0.7
|
|
CD2
|
A:HIS337
|
4.4
|
35.6
|
0.3
|
|
OE1
|
A:GLU333
|
4.4
|
38.0
|
0.3
|
|
O4
|
A:OEX601
|
4.5
|
31.1
|
0.7
|
|
O4
|
A:OEY602
|
4.5
|
33.6
|
0.3
|
|
CB
|
C:GLU354
|
4.7
|
42.2
|
0.3
|
|
NH2
|
C:ARG357
|
4.7
|
38.7
|
0.3
|
|
CB
|
C:GLU354
|
4.7
|
32.5
|
0.7
|
|
NE2
|
A:HIS332
|
4.7
|
37.3
|
0.3
|
|
CA
|
A:ASP342
|
4.7
|
38.2
|
0.3
|
|
CA
|
A:ASP342
|
4.7
|
32.0
|
0.7
|
|
C
|
A:ASP342
|
4.7
|
39.1
|
0.3
|
|
NH1
|
C:ARG357
|
4.8
|
30.9
|
0.7
|
|
C
|
A:ASP342
|
4.8
|
34.5
|
0.7
|
|
OD2
|
A:ASP170
|
4.9
|
36.9
|
0.3
|
|
O
|
A:ASP342
|
4.9
|
36.3
|
0.3
|
|
NH1
|
C:ARG357
|
4.9
|
36.6
|
0.3
|
|
OD2
|
A:ASP170
|
4.9
|
35.1
|
0.7
|
|
NH2
|
C:ARG357
|
4.9
|
30.6
|
0.7
|
|
CD
|
A:GLU189
|
5.0
|
30.4
|
0.7
|
|
Manganese binding site 3 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 3 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn601
b:31.1
occ:0.65
|
MN3
|
A:OEX601
|
0.0
|
31.1
|
0.7
|
|
MN3
|
A:OEY602
|
0.1
|
38.4
|
0.3
|
|
O2
|
A:OEY602
|
1.8
|
35.5
|
0.3
|
|
O2
|
A:OEX601
|
1.9
|
32.3
|
0.7
|
|
O4
|
A:OEY602
|
1.9
|
33.6
|
0.3
|
|
OE1
|
A:GLU333
|
1.9
|
33.1
|
0.7
|
|
O5
|
A:OEY602
|
1.9
|
37.5
|
0.3
|
|
O3
|
A:OEX601
|
2.0
|
36.5
|
0.7
|
|
O4
|
A:OEX601
|
2.0
|
31.1
|
0.7
|
|
OE1
|
A:GLU333
|
2.0
|
38.0
|
0.3
|
|
OE2
|
C:GLU354
|
2.0
|
35.0
|
0.7
|
|
O3
|
A:OEY602
|
2.0
|
38.9
|
0.3
|
|
O5
|
A:OEX601
|
2.0
|
32.1
|
0.7
|
|
OE2
|
C:GLU354
|
2.2
|
42.1
|
0.3
|
|
MN4
|
A:OEY602
|
2.7
|
40.0
|
0.3
|
|
CD
|
A:GLU333
|
2.8
|
35.0
|
0.7
|
|
MN4
|
A:OEX601
|
2.8
|
32.8
|
0.7
|
|
MN2
|
A:OEY602
|
2.8
|
36.1
|
0.3
|
|
MN2
|
A:OEX601
|
2.9
|
32.2
|
0.7
|
|
CD
|
A:GLU333
|
2.9
|
37.2
|
0.3
|
|
OE2
|
A:GLU333
|
3.0
|
30.9
|
0.7
|
|
CD
|
C:GLU354
|
3.0
|
35.6
|
0.7
|
|
CD
|
C:GLU354
|
3.0
|
39.1
|
0.3
|
|
OE2
|
A:GLU333
|
3.2
|
37.1
|
0.3
|
|
OE1
|
C:GLU354
|
3.2
|
35.4
|
0.3
|
|
OE1
|
C:GLU354
|
3.2
|
33.7
|
0.7
|
|
MN1
|
A:OEX601
|
3.3
|
29.9
|
0.7
|
|
MN1
|
A:OEY602
|
3.4
|
34.3
|
0.3
|
|
CA1
|
A:OEY602
|
3.4
|
40.0
|
0.3
|
|
O1
|
A:OEY602
|
3.4
|
32.5
|
0.3
|
|
O
|
C:HOH602
|
3.5
|
38.0
|
0.7
|
|
O1
|
A:OEX601
|
3.5
|
31.5
|
0.7
|
|
O6
|
A:OEY602
|
3.5
|
38.9
|
0.3
|
|
CA1
|
A:OEX601
|
3.5
|
32.8
|
0.7
|
|
NH2
|
C:ARG357
|
3.8
|
38.7
|
0.3
|
|
OD2
|
A:ASP170
|
3.9
|
36.9
|
0.3
|
|
OD1
|
A:ASP170
|
3.9
|
27.8
|
0.7
|
|
OD1
|
A:ASP170
|
4.0
|
40.3
|
0.3
|
|
NH2
|
C:ARG357
|
4.0
|
30.6
|
0.7
|
|
O
|
A:HOH704
|
4.1
|
33.8
|
1.0
|
|
NE2
|
A:HIS332
|
4.1
|
37.0
|
0.7
|
|
OD2
|
A:ASP170
|
4.1
|
35.1
|
0.7
|
|
CG
|
A:GLU333
|
4.2
|
32.0
|
0.7
|
|
NE2
|
A:HIS337
|
4.2
|
36.4
|
0.3
|
|
NE2
|
A:HIS337
|
4.3
|
33.9
|
0.7
|
|
O
|
A:HOH722
|
4.3
|
29.3
|
0.7
|
|
CG
|
A:GLU333
|
4.3
|
34.1
|
0.3
|
|
CG
|
C:GLU354
|
4.3
|
32.5
|
0.7
|
|
O
|
A:HOH722
|
4.4
|
39.8
|
0.3
|
|
OXT
|
A:ALA344
|
4.4
|
34.0
|
0.7
|
|
O
|
A:HOH733
|
4.4
|
40.8
|
0.3
|
|
CG
|
A:ASP170
|
4.4
|
36.5
|
0.3
|
|
CD2
|
A:HIS332
|
4.4
|
31.7
|
0.7
|
|
OXT
|
A:ALA344
|
4.4
|
37.1
|
0.3
|
|
CG
|
C:GLU354
|
4.4
|
41.4
|
0.3
|
|
CG
|
A:ASP170
|
4.4
|
32.1
|
0.7
|
|
NE2
|
A:HIS332
|
4.5
|
37.3
|
0.3
|
|
OD1
|
A:ASP342
|
4.6
|
35.6
|
0.3
|
|
OD1
|
A:ASP342
|
4.6
|
34.1
|
0.7
|
|
OD2
|
A:ASP342
|
4.6
|
35.2
|
0.3
|
|
O
|
A:HOH733
|
4.6
|
29.1
|
0.7
|
|
CB
|
A:GLU333
|
4.7
|
29.2
|
0.7
|
|
O
|
A:HOH797
|
4.7
|
37.4
|
0.3
|
|
O
|
A:ALA344
|
4.7
|
36.2
|
0.7
|
|
CD2
|
A:HIS332
|
4.7
|
36.1
|
0.3
|
|
OE2
|
A:GLU189
|
4.7
|
30.2
|
0.7
|
|
O
|
A:ALA344
|
4.7
|
37.0
|
0.3
|
|
CB
|
A:GLU333
|
4.7
|
33.0
|
0.3
|
|
O
|
A:HOH797
|
4.8
|
33.0
|
0.7
|
|
OD2
|
A:ASP342
|
4.8
|
35.8
|
0.7
|
|
CZ
|
C:ARG357
|
4.9
|
35.5
|
0.3
|
|
CZ
|
C:ARG357
|
4.9
|
30.5
|
0.7
|
|
CE1
|
A:HIS337
|
4.9
|
32.7
|
0.7
|
|
CE1
|
A:HIS337
|
5.0
|
36.6
|
0.3
|
|
Manganese binding site 4 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 4 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn601
b:32.8
occ:0.65
|
MN4
|
A:OEX601
|
0.0
|
32.8
|
0.7
|
|
MN4
|
A:OEY602
|
0.2
|
40.0
|
0.3
|
|
O4
|
A:OEX601
|
1.8
|
31.1
|
0.7
|
|
OE2
|
A:GLU333
|
1.8
|
30.9
|
0.7
|
|
O4
|
A:OEY602
|
1.9
|
33.6
|
0.3
|
|
O
|
A:HOH733
|
1.9
|
40.8
|
0.3
|
|
OE2
|
A:GLU333
|
2.0
|
37.1
|
0.3
|
|
OD1
|
A:ASP170
|
2.0
|
40.3
|
0.3
|
|
OD1
|
A:ASP170
|
2.0
|
27.8
|
0.7
|
|
O
|
A:HOH722
|
2.0
|
29.3
|
0.7
|
|
O
|
A:HOH722
|
2.1
|
39.8
|
0.3
|
|
O5
|
A:OEY602
|
2.2
|
37.5
|
0.3
|
|
O
|
A:HOH733
|
2.2
|
29.1
|
0.7
|
|
O5
|
A:OEX601
|
2.3
|
32.1
|
0.7
|
|
MN3
|
A:OEX601
|
2.8
|
31.1
|
0.7
|
|
MN3
|
A:OEY602
|
2.8
|
38.4
|
0.3
|
|
CD
|
A:GLU333
|
2.8
|
35.0
|
0.7
|
|
CD
|
A:GLU333
|
2.9
|
37.2
|
0.3
|
|
CG
|
A:ASP170
|
3.0
|
36.5
|
0.3
|
|
CG
|
A:ASP170
|
3.1
|
32.1
|
0.7
|
|
OE1
|
A:GLU333
|
3.2
|
38.0
|
0.3
|
|
OE1
|
A:GLU333
|
3.2
|
33.1
|
0.7
|
|
OD2
|
A:ASP170
|
3.4
|
36.9
|
0.3
|
|
OD2
|
A:ASP170
|
3.5
|
35.1
|
0.7
|
|
O
|
A:HOH797
|
3.6
|
37.4
|
0.3
|
|
O
|
A:HOH797
|
3.7
|
33.0
|
0.7
|
|
O
|
A:HOH704
|
3.7
|
33.8
|
1.0
|
|
O2
|
A:OEY602
|
3.8
|
35.5
|
0.3
|
|
O2
|
A:OEX601
|
3.8
|
32.3
|
0.7
|
|
O
|
A:HOH762
|
3.9
|
27.8
|
1.0
|
|
CA1
|
A:OEY602
|
4.0
|
40.0
|
0.3
|
|
CA1
|
A:OEX601
|
4.1
|
32.8
|
0.7
|
|
O6
|
A:OEY602
|
4.1
|
38.9
|
0.3
|
|
OD1
|
A:ASP61
|
4.1
|
32.2
|
0.7
|
|
OD1
|
A:ASP61
|
4.1
|
32.5
|
0.3
|
|
CG
|
A:GLU333
|
4.2
|
32.0
|
0.7
|
|
O
|
A:SER169
|
4.2
|
31.0
|
0.7
|
|
CG
|
A:GLU333
|
4.3
|
34.1
|
0.3
|
|
CB
|
A:ASP170
|
4.3
|
35.3
|
0.3
|
|
O
|
A:HOH780
|
4.3
|
35.9
|
1.0
|
|
CB
|
A:ASP170
|
4.3
|
29.8
|
0.7
|
|
O
|
A:SER169
|
4.3
|
36.4
|
0.3
|
|
OE2
|
C:GLU354
|
4.4
|
35.0
|
0.7
|
|
O3
|
A:OEX601
|
4.4
|
36.5
|
0.7
|
|
CA
|
A:ASP170
|
4.5
|
29.5
|
0.7
|
|
CA
|
A:ASP170
|
4.5
|
36.3
|
0.3
|
|
O3
|
A:OEY602
|
4.5
|
38.9
|
0.3
|
|
NH2
|
C:ARG357
|
4.5
|
38.7
|
0.3
|
|
NH2
|
C:ARG357
|
4.6
|
30.6
|
0.7
|
|
OE2
|
C:GLU354
|
4.6
|
42.1
|
0.3
|
|
O
|
C:HOH602
|
4.6
|
38.0
|
0.7
|
|
C
|
A:SER169
|
4.8
|
29.6
|
0.7
|
|
OG
|
A:SER169
|
4.8
|
32.1
|
0.7
|
|
N
|
A:ASP170
|
4.9
|
30.5
|
0.7
|
|
C
|
A:SER169
|
4.9
|
37.6
|
0.3
|
|
N
|
A:ASP170
|
4.9
|
39.1
|
0.3
|
|
Manganese binding site 5 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 5 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 5 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn602
b:34.3
occ:0.35
|
MN1
|
A:OEY602
|
0.0
|
34.3
|
0.3
|
|
MN1
|
A:OEX601
|
0.0
|
29.9
|
0.7
|
|
OE2
|
A:GLU189
|
1.7
|
30.2
|
0.7
|
|
O6
|
A:OEY602
|
1.8
|
38.9
|
0.3
|
|
O3
|
A:OEY602
|
1.9
|
38.9
|
0.3
|
|
O3
|
A:OEX601
|
1.9
|
36.5
|
0.7
|
|
O1
|
A:OEX601
|
1.9
|
31.5
|
0.7
|
|
O1
|
A:OEY602
|
1.9
|
32.5
|
0.3
|
|
NE2
|
A:HIS332
|
2.0
|
37.0
|
0.7
|
|
OE2
|
A:GLU189
|
2.0
|
37.6
|
0.3
|
|
OD2
|
A:ASP342
|
2.0
|
35.2
|
0.3
|
|
OD2
|
A:ASP342
|
2.0
|
35.8
|
0.7
|
|
NE2
|
A:HIS332
|
2.2
|
37.3
|
0.3
|
|
MN2
|
A:OEY602
|
2.8
|
36.1
|
0.3
|
|
MN2
|
A:OEX601
|
2.8
|
32.2
|
0.7
|
|
O5
|
A:OEX601
|
2.8
|
32.1
|
0.7
|
|
O5
|
A:OEY602
|
2.9
|
37.5
|
0.3
|
|
CD
|
A:GLU189
|
2.9
|
30.4
|
0.7
|
|
CE1
|
A:HIS332
|
2.9
|
33.5
|
0.7
|
|
CG
|
A:ASP342
|
3.0
|
37.3
|
0.7
|
|
CG
|
A:ASP342
|
3.0
|
37.6
|
0.3
|
|
CD2
|
A:HIS332
|
3.0
|
31.7
|
0.7
|
|
CD
|
A:GLU189
|
3.1
|
37.9
|
0.3
|
|
CD2
|
A:HIS332
|
3.1
|
36.1
|
0.3
|
|
CE1
|
A:HIS332
|
3.2
|
34.3
|
0.3
|
|
OD1
|
A:ASP342
|
3.2
|
34.1
|
0.7
|
|
OD1
|
A:ASP342
|
3.3
|
35.6
|
0.3
|
|
CA1
|
A:OEY602
|
3.4
|
40.0
|
0.3
|
|
MN3
|
A:OEX601
|
3.4
|
31.1
|
0.7
|
|
MN3
|
A:OEY602
|
3.4
|
38.4
|
0.3
|
|
CA1
|
A:OEX601
|
3.4
|
32.8
|
0.7
|
|
O2
|
A:OEX601
|
3.4
|
32.3
|
0.7
|
|
O2
|
A:OEY602
|
3.5
|
35.5
|
0.3
|
|
OE1
|
A:GLU189
|
3.5
|
35.2
|
0.3
|
|
OE1
|
A:GLU189
|
3.5
|
34.2
|
0.7
|
|
O
|
A:HOH706
|
3.7
|
32.7
|
1.0
|
|
NE2
|
A:HIS337
|
4.0
|
33.9
|
0.7
|
|
OE1
|
A:GLU333
|
4.0
|
38.0
|
0.3
|
|
ND1
|
A:HIS332
|
4.0
|
26.4
|
0.7
|
|
CG
|
A:GLU189
|
4.0
|
30.1
|
0.7
|
|
NE2
|
A:HIS337
|
4.1
|
36.4
|
0.3
|
|
CG
|
A:HIS332
|
4.1
|
30.0
|
0.7
|
|
OE1
|
A:GLU333
|
4.1
|
33.1
|
0.7
|
|
OE1
|
C:GLU354
|
4.2
|
33.7
|
0.7
|
|
CG
|
A:HIS332
|
4.3
|
37.5
|
0.3
|
|
CG
|
A:GLU189
|
4.3
|
38.2
|
0.3
|
|
ND1
|
A:HIS332
|
4.3
|
33.4
|
0.3
|
|
CB
|
A:ASP342
|
4.3
|
38.8
|
0.3
|
|
OXT
|
A:ALA344
|
4.3
|
34.0
|
0.7
|
|
OE1
|
C:GLU354
|
4.3
|
35.4
|
0.3
|
|
CB
|
A:ASP342
|
4.4
|
37.4
|
0.7
|
|
OXT
|
A:ALA344
|
4.4
|
37.1
|
0.3
|
|
CG1
|
A:VAL185
|
4.5
|
35.0
|
0.3
|
|
OE2
|
C:GLU354
|
4.6
|
42.1
|
0.3
|
|
CG1
|
A:VAL185
|
4.6
|
26.5
|
0.7
|
|
O
|
A:HOH797
|
4.7
|
37.4
|
0.3
|
|
CD
|
A:GLU333
|
4.7
|
35.0
|
0.7
|
|
O
|
A:HOH806
|
4.7
|
37.8
|
0.6
|
|
O
|
A:ALA344
|
4.7
|
36.2
|
0.7
|
|
OE2
|
C:GLU354
|
4.7
|
35.0
|
0.7
|
|
O
|
A:HOH797
|
4.8
|
33.0
|
0.7
|
|
CE1
|
A:HIS337
|
4.8
|
36.6
|
0.3
|
|
O
|
A:ALA344
|
4.8
|
37.0
|
0.3
|
|
CE1
|
A:HIS337
|
4.8
|
32.7
|
0.7
|
|
CD
|
C:GLU354
|
4.9
|
39.1
|
0.3
|
|
C
|
A:ALA344
|
4.9
|
35.4
|
0.7
|
|
CD
|
A:GLU333
|
4.9
|
37.2
|
0.3
|
|
C
|
A:ALA344
|
4.9
|
36.6
|
0.3
|
|
CD
|
C:GLU354
|
4.9
|
35.6
|
0.7
|
|
CD2
|
A:HIS337
|
4.9
|
32.0
|
0.7
|
|
OE2
|
A:GLU333
|
5.0
|
30.9
|
0.7
|
|
Manganese binding site 6 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 6 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 6 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn602
b:36.1
occ:0.35
|
MN2
|
A:OEY602
|
0.0
|
36.1
|
0.3
|
|
MN2
|
A:OEX601
|
0.1
|
32.2
|
0.7
|
|
O1
|
A:OEX601
|
1.8
|
31.5
|
0.7
|
|
O1
|
A:OEY602
|
1.8
|
32.5
|
0.3
|
|
O3
|
A:OEX601
|
1.9
|
36.5
|
0.7
|
|
O3
|
A:OEY602
|
1.9
|
38.9
|
0.3
|
|
O2
|
A:OEX601
|
1.9
|
32.3
|
0.7
|
|
OE1
|
C:GLU354
|
1.9
|
35.4
|
0.3
|
|
O2
|
A:OEY602
|
1.9
|
35.5
|
0.3
|
|
OE1
|
C:GLU354
|
1.9
|
33.7
|
0.7
|
|
OXT
|
A:ALA344
|
2.0
|
34.0
|
0.7
|
|
OD1
|
A:ASP342
|
2.0
|
35.6
|
0.3
|
|
OXT
|
A:ALA344
|
2.0
|
37.1
|
0.3
|
|
OD1
|
A:ASP342
|
2.1
|
34.1
|
0.7
|
|
MN1
|
A:OEX601
|
2.8
|
29.9
|
0.7
|
|
MN1
|
A:OEY602
|
2.8
|
34.3
|
0.3
|
|
CD
|
C:GLU354
|
2.8
|
35.6
|
0.7
|
|
MN3
|
A:OEX601
|
2.8
|
31.1
|
0.7
|
|
CD
|
C:GLU354
|
2.8
|
39.1
|
0.3
|
|
MN3
|
A:OEY602
|
2.9
|
38.4
|
0.3
|
|
CG
|
A:ASP342
|
2.9
|
37.6
|
0.3
|
|
C
|
A:ALA344
|
2.9
|
35.4
|
0.7
|
|
CG
|
A:ASP342
|
2.9
|
37.3
|
0.7
|
|
C
|
A:ALA344
|
3.0
|
36.6
|
0.3
|
|
OD2
|
A:ASP342
|
3.0
|
35.2
|
0.3
|
|
OE2
|
C:GLU354
|
3.1
|
35.0
|
0.7
|
|
OE2
|
C:GLU354
|
3.1
|
42.1
|
0.3
|
|
OD2
|
A:ASP342
|
3.2
|
35.8
|
0.7
|
|
O
|
A:ALA344
|
3.2
|
36.2
|
0.7
|
|
O
|
A:ALA344
|
3.3
|
37.0
|
0.3
|
|
CA1
|
A:OEY602
|
3.3
|
40.0
|
0.3
|
|
CA1
|
A:OEX601
|
3.4
|
32.8
|
0.7
|
|
O5
|
A:OEX601
|
3.7
|
32.1
|
0.7
|
|
O5
|
A:OEY602
|
3.7
|
37.5
|
0.3
|
|
O
|
A:HOH706
|
3.7
|
32.7
|
1.0
|
|
O6
|
A:OEY602
|
3.8
|
38.9
|
0.3
|
|
O
|
A:HOH787
|
3.9
|
42.1
|
1.0
|
|
NE2
|
A:HIS337
|
3.9
|
33.9
|
0.7
|
|
NE2
|
A:HIS337
|
3.9
|
36.4
|
0.3
|
|
OE2
|
A:GLU189
|
4.1
|
30.2
|
0.7
|
|
OE2
|
A:GLU189
|
4.2
|
37.6
|
0.3
|
|
CG
|
C:GLU354
|
4.2
|
41.4
|
0.3
|
|
CG
|
C:GLU354
|
4.2
|
32.5
|
0.7
|
|
CA
|
A:ALA344
|
4.2
|
38.4
|
0.3
|
|
CA
|
A:ALA344
|
4.3
|
31.6
|
0.7
|
|
OE1
|
A:GLU333
|
4.3
|
33.1
|
0.7
|
|
N
|
A:ALA344
|
4.3
|
39.8
|
0.3
|
|
CB
|
A:ASP342
|
4.3
|
38.8
|
0.3
|
|
CD2
|
A:HIS337
|
4.3
|
32.0
|
0.7
|
|
NE2
|
A:HIS332
|
4.3
|
37.0
|
0.7
|
|
OE1
|
A:GLU333
|
4.4
|
38.0
|
0.3
|
|
N
|
A:ALA344
|
4.4
|
36.3
|
0.7
|
|
CD2
|
A:HIS337
|
4.4
|
35.6
|
0.3
|
|
CB
|
A:ASP342
|
4.4
|
37.4
|
0.7
|
|
O4
|
A:OEX601
|
4.4
|
31.1
|
0.7
|
|
O4
|
A:OEY602
|
4.4
|
33.6
|
0.3
|
|
NH2
|
C:ARG357
|
4.6
|
38.7
|
0.3
|
|
CB
|
C:GLU354
|
4.7
|
42.2
|
0.3
|
|
NE2
|
A:HIS332
|
4.7
|
37.3
|
0.3
|
|
CB
|
C:GLU354
|
4.7
|
32.5
|
0.7
|
|
CA
|
A:ASP342
|
4.8
|
38.2
|
0.3
|
|
CA
|
A:ASP342
|
4.8
|
32.0
|
0.7
|
|
C
|
A:ASP342
|
4.8
|
39.1
|
0.3
|
|
NH1
|
C:ARG357
|
4.8
|
30.9
|
0.7
|
|
OD2
|
A:ASP170
|
4.8
|
36.9
|
0.3
|
|
C
|
A:ASP342
|
4.9
|
34.5
|
0.7
|
|
OD2
|
A:ASP170
|
4.9
|
35.1
|
0.7
|
|
NH1
|
C:ARG357
|
4.9
|
36.6
|
0.3
|
|
NH2
|
C:ARG357
|
4.9
|
30.6
|
0.7
|
|
O
|
A:ASP342
|
5.0
|
36.3
|
0.3
|
|
CD
|
A:GLU189
|
5.0
|
30.4
|
0.7
|
|
Manganese binding site 7 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 7 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 7 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn602
b:38.4
occ:0.35
|
MN3
|
A:OEY602
|
0.0
|
38.4
|
0.3
|
|
MN3
|
A:OEX601
|
0.1
|
31.1
|
0.7
|
|
OE1
|
A:GLU333
|
1.8
|
33.1
|
0.7
|
|
O2
|
A:OEY602
|
1.9
|
35.5
|
0.3
|
|
OE1
|
A:GLU333
|
1.9
|
38.0
|
0.3
|
|
O4
|
A:OEY602
|
1.9
|
33.6
|
0.3
|
|
O3
|
A:OEX601
|
1.9
|
36.5
|
0.7
|
|
O2
|
A:OEX601
|
2.0
|
32.3
|
0.7
|
|
O5
|
A:OEY602
|
2.0
|
37.5
|
0.3
|
|
OE2
|
C:GLU354
|
2.0
|
35.0
|
0.7
|
|
O3
|
A:OEY602
|
2.0
|
38.9
|
0.3
|
|
O4
|
A:OEX601
|
2.0
|
31.1
|
0.7
|
|
OE2
|
C:GLU354
|
2.1
|
42.1
|
0.3
|
|
O5
|
A:OEX601
|
2.1
|
32.1
|
0.7
|
|
CD
|
A:GLU333
|
2.7
|
35.0
|
0.7
|
|
MN4
|
A:OEY602
|
2.7
|
40.0
|
0.3
|
|
MN4
|
A:OEX601
|
2.8
|
32.8
|
0.7
|
|
MN2
|
A:OEY602
|
2.9
|
36.1
|
0.3
|
|
CD
|
A:GLU333
|
2.9
|
37.2
|
0.3
|
|
OE2
|
A:GLU333
|
2.9
|
30.9
|
0.7
|
|
MN2
|
A:OEX601
|
2.9
|
32.2
|
0.7
|
|
CD
|
C:GLU354
|
2.9
|
35.6
|
0.7
|
|
CD
|
C:GLU354
|
3.0
|
39.1
|
0.3
|
|
OE2
|
A:GLU333
|
3.1
|
37.1
|
0.3
|
|
OE1
|
C:GLU354
|
3.2
|
33.7
|
0.7
|
|
OE1
|
C:GLU354
|
3.2
|
35.4
|
0.3
|
|
MN1
|
A:OEX601
|
3.3
|
29.9
|
0.7
|
|
MN1
|
A:OEY602
|
3.4
|
34.3
|
0.3
|
|
O
|
C:HOH602
|
3.4
|
38.0
|
0.7
|
|
O1
|
A:OEY602
|
3.5
|
32.5
|
0.3
|
|
CA1
|
A:OEY602
|
3.5
|
40.0
|
0.3
|
|
O6
|
A:OEY602
|
3.5
|
38.9
|
0.3
|
|
O1
|
A:OEX601
|
3.5
|
31.5
|
0.7
|
|
CA1
|
A:OEX601
|
3.6
|
32.8
|
0.7
|
|
NH2
|
C:ARG357
|
3.9
|
38.7
|
0.3
|
|
OD1
|
A:ASP170
|
4.0
|
27.8
|
0.7
|
|
OD2
|
A:ASP170
|
4.0
|
36.9
|
0.3
|
|
NE2
|
A:HIS332
|
4.0
|
37.0
|
0.7
|
|
CG
|
A:GLU333
|
4.1
|
32.0
|
0.7
|
|
O
|
A:HOH704
|
4.1
|
33.8
|
1.0
|
|
OD1
|
A:ASP170
|
4.1
|
40.3
|
0.3
|
|
NH2
|
C:ARG357
|
4.1
|
30.6
|
0.7
|
|
NE2
|
A:HIS337
|
4.2
|
36.4
|
0.3
|
|
NE2
|
A:HIS337
|
4.2
|
33.9
|
0.7
|
|
OD2
|
A:ASP170
|
4.2
|
35.1
|
0.7
|
|
CG
|
A:GLU333
|
4.2
|
34.1
|
0.3
|
|
CG
|
C:GLU354
|
4.3
|
32.5
|
0.7
|
|
O
|
A:HOH722
|
4.3
|
29.3
|
0.7
|
|
CD2
|
A:HIS332
|
4.4
|
31.7
|
0.7
|
|
O
|
A:HOH722
|
4.4
|
39.8
|
0.3
|
|
CG
|
C:GLU354
|
4.4
|
41.4
|
0.3
|
|
O
|
A:HOH733
|
4.4
|
40.8
|
0.3
|
|
OXT
|
A:ALA344
|
4.4
|
34.0
|
0.7
|
|
NE2
|
A:HIS332
|
4.5
|
37.3
|
0.3
|
|
OXT
|
A:ALA344
|
4.5
|
37.1
|
0.3
|
|
CG
|
A:ASP170
|
4.5
|
36.5
|
0.3
|
|
CB
|
A:GLU333
|
4.5
|
29.2
|
0.7
|
|
CG
|
A:ASP170
|
4.6
|
32.1
|
0.7
|
|
OD2
|
A:ASP342
|
4.6
|
35.2
|
0.3
|
|
OD1
|
A:ASP342
|
4.6
|
35.6
|
0.3
|
|
CB
|
A:GLU333
|
4.6
|
33.0
|
0.3
|
|
OD1
|
A:ASP342
|
4.6
|
34.1
|
0.7
|
|
O
|
A:HOH733
|
4.7
|
29.1
|
0.7
|
|
CD2
|
A:HIS332
|
4.7
|
36.1
|
0.3
|
|
OE2
|
A:GLU189
|
4.7
|
30.2
|
0.7
|
|
O
|
A:HOH797
|
4.8
|
37.4
|
0.3
|
|
O
|
A:ALA344
|
4.8
|
36.2
|
0.7
|
|
OD2
|
A:ASP342
|
4.8
|
35.8
|
0.7
|
|
O
|
A:ALA344
|
4.8
|
37.0
|
0.3
|
|
CE1
|
A:HIS337
|
4.8
|
32.7
|
0.7
|
|
O
|
A:HOH797
|
4.9
|
33.0
|
0.7
|
|
CE1
|
A:HIS337
|
4.9
|
36.6
|
0.3
|
|
CZ
|
C:ARG357
|
4.9
|
35.5
|
0.3
|
|
Manganese binding site 8 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 8 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 8 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn602
b:40.0
occ:0.35
|
MN4
|
A:OEY602
|
0.0
|
40.0
|
0.3
|
|
MN4
|
A:OEX601
|
0.2
|
32.8
|
0.7
|
|
O4
|
A:OEX601
|
1.6
|
31.1
|
0.7
|
|
O4
|
A:OEY602
|
1.8
|
33.6
|
0.3
|
|
OD1
|
A:ASP170
|
1.9
|
40.3
|
0.3
|
|
OD1
|
A:ASP170
|
1.9
|
27.8
|
0.7
|
|
OE2
|
A:GLU333
|
2.0
|
30.9
|
0.7
|
|
OE2
|
A:GLU333
|
2.1
|
37.1
|
0.3
|
|
O
|
A:HOH722
|
2.1
|
29.3
|
0.7
|
|
O
|
A:HOH733
|
2.1
|
40.8
|
0.3
|
|
O
|
A:HOH722
|
2.1
|
39.8
|
0.3
|
|
O5
|
A:OEY602
|
2.2
|
37.5
|
0.3
|
|
O5
|
A:OEX601
|
2.3
|
32.1
|
0.7
|
|
O
|
A:HOH733
|
2.4
|
29.1
|
0.7
|
|
MN3
|
A:OEX601
|
2.7
|
31.1
|
0.7
|
|
MN3
|
A:OEY602
|
2.7
|
38.4
|
0.3
|
|
CG
|
A:ASP170
|
2.9
|
36.5
|
0.3
|
|
CD
|
A:GLU333
|
2.9
|
35.0
|
0.7
|
|
CD
|
A:GLU333
|
3.0
|
37.2
|
0.3
|
|
CG
|
A:ASP170
|
3.0
|
32.1
|
0.7
|
|
OE1
|
A:GLU333
|
3.2
|
38.0
|
0.3
|
|
OE1
|
A:GLU333
|
3.2
|
33.1
|
0.7
|
|
OD2
|
A:ASP170
|
3.2
|
36.9
|
0.3
|
|
OD2
|
A:ASP170
|
3.4
|
35.1
|
0.7
|
|
O
|
A:HOH704
|
3.6
|
33.8
|
1.0
|
|
O
|
A:HOH797
|
3.6
|
37.4
|
0.3
|
|
O2
|
A:OEY602
|
3.6
|
35.5
|
0.3
|
|
O2
|
A:OEX601
|
3.7
|
32.3
|
0.7
|
|
O
|
A:HOH797
|
3.7
|
33.0
|
0.7
|
|
CA1
|
A:OEY602
|
3.9
|
40.0
|
0.3
|
|
CA1
|
A:OEX601
|
4.0
|
32.8
|
0.7
|
|
OD1
|
A:ASP61
|
4.1
|
32.5
|
0.3
|
|
OD1
|
A:ASP61
|
4.1
|
32.2
|
0.7
|
|
O6
|
A:OEY602
|
4.1
|
38.9
|
0.3
|
|
O
|
A:HOH762
|
4.1
|
27.8
|
1.0
|
|
O
|
A:SER169
|
4.2
|
31.0
|
0.7
|
|
CB
|
A:ASP170
|
4.2
|
35.3
|
0.3
|
|
OE2
|
C:GLU354
|
4.3
|
35.0
|
0.7
|
|
CB
|
A:ASP170
|
4.3
|
29.8
|
0.7
|
|
CG
|
A:GLU333
|
4.3
|
32.0
|
0.7
|
|
O
|
A:SER169
|
4.3
|
36.4
|
0.3
|
|
NH2
|
C:ARG357
|
4.3
|
38.7
|
0.3
|
|
CG
|
A:GLU333
|
4.4
|
34.1
|
0.3
|
|
NH2
|
C:ARG357
|
4.4
|
30.6
|
0.7
|
|
O
|
A:HOH780
|
4.4
|
35.9
|
1.0
|
|
O3
|
A:OEX601
|
4.4
|
36.5
|
0.7
|
|
CA
|
A:ASP170
|
4.4
|
29.5
|
0.7
|
|
CA
|
A:ASP170
|
4.4
|
36.3
|
0.3
|
|
O3
|
A:OEY602
|
4.5
|
38.9
|
0.3
|
|
OE2
|
C:GLU354
|
4.5
|
42.1
|
0.3
|
|
O
|
C:HOH602
|
4.5
|
38.0
|
0.7
|
|
OG
|
A:SER169
|
4.7
|
32.1
|
0.7
|
|
C
|
A:SER169
|
4.7
|
29.6
|
0.7
|
|
N
|
A:ASP170
|
4.8
|
30.5
|
0.7
|
|
C
|
A:SER169
|
4.8
|
37.6
|
0.3
|
|
N
|
A:ASP170
|
4.9
|
39.1
|
0.3
|
|
Manganese binding site 9 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 9 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 9 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
a:Mn601
b:31.4
occ:0.65
|
MN1
|
a:OEX601
|
0.0
|
31.4
|
0.7
|
|
MN1
|
a:OEY602
|
0.0
|
37.7
|
0.3
|
|
OE2
|
a:GLU189
|
1.7
|
32.4
|
0.7
|
|
O6
|
a:OEY602
|
1.8
|
43.5
|
0.3
|
|
O3
|
a:OEY602
|
1.9
|
38.1
|
0.3
|
|
O3
|
a:OEX601
|
1.9
|
33.5
|
0.7
|
|
O1
|
a:OEY602
|
1.9
|
36.9
|
0.3
|
|
O1
|
a:OEX601
|
2.0
|
34.3
|
0.7
|
|
OD2
|
a:ASP342
|
2.0
|
37.5
|
0.3
|
|
OE2
|
a:GLU189
|
2.1
|
38.6
|
0.3
|
|
NE2
|
a:HIS332
|
2.2
|
33.5
|
0.7
|
|
NE2
|
a:HIS332
|
2.3
|
39.2
|
0.3
|
|
OD2
|
a:ASP342
|
2.3
|
35.4
|
0.7
|
|
O5
|
a:OEX601
|
2.7
|
36.8
|
0.7
|
|
MN2
|
a:OEY602
|
2.8
|
35.3
|
0.3
|
|
CD
|
a:GLU189
|
2.8
|
29.4
|
0.7
|
|
MN2
|
a:OEX601
|
2.8
|
32.3
|
0.7
|
|
O5
|
a:OEY602
|
2.9
|
39.4
|
0.3
|
|
CG
|
a:ASP342
|
3.0
|
41.7
|
0.3
|
|
CD
|
a:GLU189
|
3.0
|
39.6
|
0.3
|
|
CE1
|
a:HIS332
|
3.1
|
31.7
|
0.7
|
|
CD2
|
a:HIS332
|
3.1
|
38.9
|
0.3
|
|
CG
|
a:ASP342
|
3.2
|
36.8
|
0.7
|
|
CD2
|
a:HIS332
|
3.2
|
31.5
|
0.7
|
|
OD1
|
a:ASP342
|
3.3
|
37.6
|
0.3
|
|
MN3
|
a:OEX601
|
3.3
|
31.7
|
0.7
|
|
OE1
|
a:GLU189
|
3.3
|
29.5
|
0.7
|
|
CE1
|
a:HIS332
|
3.3
|
39.4
|
0.3
|
|
MN3
|
a:OEY602
|
3.3
|
38.7
|
0.3
|
|
CA1
|
a:OEY602
|
3.3
|
40.5
|
0.3
|
|
OD1
|
a:ASP342
|
3.4
|
33.8
|
0.7
|
|
OE1
|
a:GLU189
|
3.4
|
40.8
|
0.3
|
|
CA1
|
a:OEX601
|
3.4
|
36.5
|
0.7
|
|
O2
|
a:OEX601
|
3.4
|
29.9
|
0.7
|
|
O2
|
a:OEY602
|
3.4
|
36.2
|
0.3
|
|
NE2
|
a:HIS337
|
3.9
|
37.0
|
0.3
|
|
CG
|
a:GLU189
|
3.9
|
34.1
|
0.7
|
|
OE1
|
a:GLU333
|
4.0
|
32.3
|
0.7
|
|
NE2
|
a:HIS337
|
4.0
|
32.1
|
0.7
|
|
O
|
a:HOH703
|
4.0
|
38.0
|
1.0
|
|
OE1
|
a:GLU333
|
4.2
|
35.9
|
0.3
|
|
ND1
|
a:HIS332
|
4.2
|
34.3
|
0.7
|
|
OXT
|
a:ALA344
|
4.3
|
34.2
|
0.3
|
|
CG
|
a:GLU189
|
4.3
|
41.1
|
0.3
|
|
CB
|
a:ASP342
|
4.3
|
40.2
|
0.3
|
|
OE1
|
c:GLU354
|
4.3
|
37.1
|
0.3
|
|
CG
|
a:HIS332
|
4.3
|
29.6
|
0.7
|
|
CG
|
a:HIS332
|
4.3
|
38.1
|
0.3
|
|
OXT
|
a:ALA344
|
4.3
|
33.1
|
0.7
|
|
ND1
|
a:HIS332
|
4.4
|
40.2
|
0.3
|
|
CG1
|
a:VAL185
|
4.4
|
31.8
|
0.7
|
|
CE1
|
a:HIS337
|
4.5
|
39.2
|
0.3
|
|
CB
|
a:ASP342
|
4.5
|
37.1
|
0.7
|
|
OE1
|
c:GLU354
|
4.5
|
33.8
|
0.7
|
|
CG1
|
a:VAL185
|
4.6
|
36.0
|
0.3
|
|
CD
|
a:GLU333
|
4.6
|
33.4
|
0.7
|
|
OE2
|
c:GLU354
|
4.6
|
34.9
|
0.7
|
|
OE2
|
c:GLU354
|
4.7
|
38.1
|
0.3
|
|
O
|
a:HOH786
|
4.7
|
37.6
|
0.3
|
|
O
|
a:ALA344
|
4.7
|
40.6
|
0.3
|
|
O
|
a:HOH786
|
4.8
|
33.2
|
0.7
|
|
O
|
a:ALA344
|
4.8
|
33.7
|
0.7
|
|
CE1
|
a:HIS337
|
4.8
|
33.6
|
0.7
|
|
C
|
a:ALA344
|
4.8
|
39.0
|
0.3
|
|
CD2
|
a:HIS337
|
4.9
|
34.7
|
0.7
|
|
CD
|
c:GLU354
|
4.9
|
39.4
|
0.3
|
|
OE2
|
a:GLU333
|
4.9
|
32.9
|
0.7
|
|
CD
|
a:GLU333
|
4.9
|
36.8
|
0.3
|
|
CD2
|
a:HIS337
|
4.9
|
35.7
|
0.3
|
|
CD
|
c:GLU354
|
4.9
|
34.4
|
0.7
|
|
C
|
a:ALA344
|
5.0
|
36.5
|
0.7
|
|
MN4
|
a:OEX601
|
5.0
|
31.0
|
0.7
|
|
Manganese binding site 10 out
of 16 in 8f4k
Go back to
Manganese Binding Sites List in 8f4k
Manganese binding site 10 out
of 16 in the Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution
 Mono view
 Stereo pair view
|
|
A full contact list of Manganese with other atoms in the Mn binding
site number 10 of Rt Xfel Structure of the Three-Flash State of Photosystem II (3F, S0- Rich) at 2.16 Angstrom Resolution within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
a:Mn601
b:32.3
occ:0.65
|
MN2
|
a:OEX601
|
0.0
|
32.3
|
0.7
|
|
MN2
|
a:OEY602
|
0.1
|
35.3
|
0.3
|
|
O1
|
a:OEY602
|
1.8
|
36.9
|
0.3
|
|
O1
|
a:OEX601
|
1.8
|
34.3
|
0.7
|
|
OXT
|
a:ALA344
|
1.9
|
34.2
|
0.3
|
|
O2
|
a:OEX601
|
1.9
|
29.9
|
0.7
|
|
O3
|
a:OEX601
|
1.9
|
33.5
|
0.7
|
|
O2
|
a:OEY602
|
1.9
|
36.2
|
0.3
|
|
O3
|
a:OEY602
|
1.9
|
38.1
|
0.3
|
|
OE1
|
c:GLU354
|
2.0
|
37.1
|
0.3
|
|
OE1
|
c:GLU354
|
2.0
|
33.8
|
0.7
|
|
OD1
|
a:ASP342
|
2.0
|
37.6
|
0.3
|
|
OXT
|
a:ALA344
|
2.0
|
33.1
|
0.7
|
|
OD1
|
a:ASP342
|
2.2
|
33.8
|
0.7
|
|
MN1
|
a:OEX601
|
2.8
|
31.4
|
0.7
|
|
MN1
|
a:OEY602
|
2.8
|
37.7
|
0.3
|
|
CD
|
c:GLU354
|
2.8
|
34.4
|
0.7
|
|
MN3
|
a:OEX601
|
2.8
|
31.7
|
0.7
|
|
CG
|
a:ASP342
|
2.9
|
41.7
|
0.3
|
|
C
|
a:ALA344
|
2.9
|
39.0
|
0.3
|
|
MN3
|
a:OEY602
|
2.9
|
38.7
|
0.3
|
|
CD
|
c:GLU354
|
3.0
|
39.4
|
0.3
|
|
C
|
a:ALA344
|
3.0
|
36.5
|
0.7
|
|
OE2
|
c:GLU354
|
3.0
|
34.9
|
0.7
|
|
CG
|
a:ASP342
|
3.1
|
36.8
|
0.7
|
|
OD2
|
a:ASP342
|
3.1
|
37.5
|
0.3
|
|
O
|
a:ALA344
|
3.3
|
40.6
|
0.3
|
|
O
|
a:ALA344
|
3.3
|
33.7
|
0.7
|
|
OD2
|
a:ASP342
|
3.3
|
35.4
|
0.7
|
|
OE2
|
c:GLU354
|
3.3
|
38.1
|
0.3
|
|
CA1
|
a:OEY602
|
3.4
|
40.5
|
0.3
|
|
CA1
|
a:OEX601
|
3.4
|
36.5
|
0.7
|
|
O5
|
a:OEX601
|
3.7
|
36.8
|
0.7
|
|
NE2
|
a:HIS337
|
3.8
|
37.0
|
0.3
|
|
O5
|
a:OEY602
|
3.8
|
39.4
|
0.3
|
|
O
|
c:HOH684
|
3.8
|
38.1
|
1.0
|
|
O6
|
a:OEY602
|
3.8
|
43.5
|
0.3
|
|
O
|
a:HOH703
|
4.1
|
38.0
|
1.0
|
|
NE2
|
a:HIS337
|
4.1
|
32.1
|
0.7
|
|
OE2
|
a:GLU189
|
4.2
|
38.6
|
0.3
|
|
OE2
|
a:GLU189
|
4.2
|
32.4
|
0.7
|
|
CA
|
a:ALA344
|
4.2
|
37.4
|
0.3
|
|
CG
|
c:GLU354
|
4.2
|
34.4
|
0.7
|
|
CD2
|
a:HIS337
|
4.2
|
35.7
|
0.3
|
|
N
|
a:ALA344
|
4.3
|
37.5
|
0.3
|
|
CB
|
a:ASP342
|
4.3
|
40.2
|
0.3
|
|
CA
|
a:ALA344
|
4.3
|
34.7
|
0.7
|
|
CG
|
c:GLU354
|
4.3
|
36.2
|
0.3
|
|
CD2
|
a:HIS337
|
4.4
|
34.7
|
0.7
|
|
OE1
|
a:GLU333
|
4.4
|
32.3
|
0.7
|
|
N
|
a:ALA344
|
4.4
|
37.2
|
0.7
|
|
CB
|
a:ASP342
|
4.5
|
37.1
|
0.7
|
|
O4
|
a:OEX601
|
4.5
|
33.2
|
0.7
|
|
C
|
a:ASP342
|
4.6
|
41.9
|
0.3
|
|
NE2
|
a:HIS332
|
4.6
|
33.5
|
0.7
|
|
O
|
a:ASP342
|
4.6
|
37.8
|
0.3
|
|
OE1
|
a:GLU333
|
4.6
|
35.9
|
0.3
|
|
CA
|
a:ASP342
|
4.6
|
38.5
|
0.3
|
|
O4
|
a:OEY602
|
4.7
|
37.1
|
0.3
|
|
NE2
|
a:HIS332
|
4.7
|
39.2
|
0.3
|
|
CD
|
a:GLU189
|
4.7
|
29.4
|
0.7
|
|
CB
|
c:GLU354
|
4.8
|
36.3
|
0.3
|
|
OD2
|
a:ASP170
|
4.8
|
37.3
|
0.7
|
|
OE1
|
a:GLU189
|
4.8
|
29.5
|
0.7
|
|
OE1
|
a:GLU189
|
4.8
|
40.8
|
0.3
|
|
NH2
|
c:ARG357
|
4.8
|
33.6
|
0.7
|
|
NH1
|
c:ARG357
|
4.8
|
34.5
|
0.7
|
|
NH1
|
c:ARG357
|
4.8
|
33.7
|
0.3
|
|
CB
|
c:GLU354
|
4.8
|
32.6
|
0.7
|
|
C
|
a:ASP342
|
4.8
|
36.9
|
0.7
|
|
CA
|
a:ASP342
|
4.8
|
36.4
|
0.7
|
|
NH2
|
c:ARG357
|
4.9
|
37.3
|
0.3
|
|
OD2
|
a:ASP170
|
4.9
|
37.2
|
0.3
|
|
CD
|
a:GLU189
|
4.9
|
39.6
|
0.3
|
|
CE1
|
a:HIS337
|
5.0
|
39.2
|
0.3
|
|
Reference:
A.Bhowmick,
R.Hussein,
I.Bogacz,
P.S.Simon,
M.Ibrahim,
R.Chatterjee,
M.D.Doyle,
M.H.Cheah,
T.Fransson,
P.Chernev,
I.-S.Kim,
H.Makita,
M.Dasgupta,
C.J.Kaminsky,
M.Zhang,
J.Gatcke,
S.Haupt,
I.I.Nangca,
S.M.Keable,
O.Aydin,
K.Tono,
S.Owada,
L.B.Gee,
F.D.Fuller,
A.Batyuk,
R.Alonso-Mori,
J.M.Holton,
D.W.Paley,
N.W.Moriarty,
F.Mamedov,
P.D.Adams,
A.S.Brewster,
H.Dobbek,
N.K.Sauter,
U.Bergmann,
A.Zouni,
J.Messinger,
J.Kern,
J.Yano,
V.K.Yachandra.
Structural Evidence For Intermediates During O2 Formation in Photosystem II To Be Published.
Page generated: Sun Oct 6 11:50:24 2024
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