Manganese in PDB 1cvn: Concanavalin A Complexed to Trimannoside
Protein crystallography data
The structure of Concanavalin A Complexed to Trimannoside, PDB code: 1cvn
was solved by
J.H.Naismith,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
8.00 /
2.30
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
81.650,
66.680,
108.320,
90.00,
97.79,
90.00
|
R / Rfree (%)
|
20.4 /
25.5
|
Other elements in 1cvn:
The structure of Concanavalin A Complexed to Trimannoside also contains other interesting chemical elements:
Manganese Binding Sites:
The binding sites of Manganese atom in the Concanavalin A Complexed to Trimannoside
(pdb code 1cvn). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 4 binding sites of Manganese where determined in the
Concanavalin A Complexed to Trimannoside, PDB code: 1cvn:
Jump to Manganese binding site number:
1;
2;
3;
4;
Manganese binding site 1 out
of 4 in 1cvn
Go back to
Manganese Binding Sites List in 1cvn
Manganese binding site 1 out
of 4 in the Concanavalin A Complexed to Trimannoside
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Concanavalin A Complexed to Trimannoside within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn238
b:18.2
occ:1.00
|
O
|
A:HOH245
|
2.1
|
2.0
|
1.0
|
OD2
|
A:ASP10
|
2.1
|
18.2
|
1.0
|
O
|
A:HOH254
|
2.2
|
6.7
|
1.0
|
OD1
|
A:ASP19
|
2.3
|
14.0
|
1.0
|
OE2
|
A:GLU8
|
2.3
|
15.9
|
1.0
|
NE2
|
A:HIS24
|
2.5
|
10.4
|
1.0
|
CG
|
A:ASP19
|
3.1
|
13.0
|
1.0
|
CG
|
A:ASP10
|
3.2
|
15.2
|
1.0
|
CD
|
A:GLU8
|
3.3
|
10.9
|
1.0
|
CD2
|
A:HIS24
|
3.4
|
11.7
|
1.0
|
CE1
|
A:HIS24
|
3.4
|
5.9
|
1.0
|
OD2
|
A:ASP19
|
3.5
|
13.8
|
1.0
|
OE1
|
A:GLU8
|
3.5
|
11.2
|
1.0
|
CB
|
A:ASP10
|
3.6
|
12.9
|
1.0
|
O
|
A:HOH251
|
3.9
|
12.2
|
1.0
|
OG
|
A:SER34
|
4.0
|
3.3
|
1.0
|
CA
|
A:CA239
|
4.3
|
8.7
|
1.0
|
OD1
|
A:ASP10
|
4.3
|
16.2
|
1.0
|
CB
|
A:ASP19
|
4.3
|
14.8
|
1.0
|
O
|
A:HOH305
|
4.4
|
53.3
|
1.0
|
O
|
A:VAL32
|
4.5
|
10.3
|
1.0
|
ND1
|
A:HIS24
|
4.5
|
10.9
|
1.0
|
CG
|
A:HIS24
|
4.6
|
14.7
|
1.0
|
CG
|
A:GLU8
|
4.6
|
10.0
|
1.0
|
CA
|
A:ASP19
|
4.6
|
14.4
|
1.0
|
CD
|
A:PRO20
|
4.8
|
17.7
|
1.0
|
|
Manganese binding site 2 out
of 4 in 1cvn
Go back to
Manganese Binding Sites List in 1cvn
Manganese binding site 2 out
of 4 in the Concanavalin A Complexed to Trimannoside
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Concanavalin A Complexed to Trimannoside within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mn238
b:24.6
occ:1.00
|
O
|
B:HOH246
|
2.1
|
11.8
|
1.0
|
OD2
|
B:ASP10
|
2.2
|
12.1
|
1.0
|
OE2
|
B:GLU8
|
2.3
|
23.2
|
1.0
|
O
|
B:HOH248
|
2.4
|
9.6
|
1.0
|
OD1
|
B:ASP19
|
2.4
|
14.0
|
1.0
|
NE2
|
B:HIS24
|
2.5
|
14.4
|
1.0
|
CG
|
B:ASP19
|
3.2
|
11.4
|
1.0
|
CG
|
B:ASP10
|
3.2
|
12.9
|
1.0
|
CD
|
B:GLU8
|
3.2
|
20.4
|
1.0
|
CE1
|
B:HIS24
|
3.5
|
12.1
|
1.0
|
OE1
|
B:GLU8
|
3.5
|
20.2
|
1.0
|
CD2
|
B:HIS24
|
3.5
|
17.9
|
1.0
|
OD2
|
B:ASP19
|
3.5
|
10.2
|
1.0
|
CB
|
B:ASP10
|
3.6
|
13.5
|
1.0
|
O
|
B:HOH250
|
4.0
|
11.2
|
1.0
|
OG
|
B:SER34
|
4.1
|
8.4
|
1.0
|
CA
|
B:CA239
|
4.3
|
12.5
|
1.0
|
OD1
|
B:ASP10
|
4.3
|
11.4
|
1.0
|
CB
|
B:ASP19
|
4.4
|
13.9
|
1.0
|
O
|
B:VAL32
|
4.5
|
13.6
|
1.0
|
ND1
|
B:HIS24
|
4.6
|
18.3
|
1.0
|
CG
|
B:GLU8
|
4.6
|
17.0
|
1.0
|
CG
|
B:HIS24
|
4.6
|
15.8
|
1.0
|
CA
|
B:ASP19
|
4.7
|
16.1
|
1.0
|
CD
|
B:PRO20
|
4.8
|
17.5
|
1.0
|
|
Manganese binding site 3 out
of 4 in 1cvn
Go back to
Manganese Binding Sites List in 1cvn
Manganese binding site 3 out
of 4 in the Concanavalin A Complexed to Trimannoside
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Concanavalin A Complexed to Trimannoside within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mn238
b:23.9
occ:1.00
|
OD2
|
C:ASP10
|
2.0
|
13.6
|
1.0
|
O
|
C:HOH252
|
2.2
|
14.8
|
1.0
|
O
|
C:HOH253
|
2.3
|
10.0
|
1.0
|
OE2
|
C:GLU8
|
2.3
|
15.2
|
1.0
|
OD1
|
C:ASP19
|
2.5
|
14.9
|
1.0
|
NE2
|
C:HIS24
|
2.5
|
15.2
|
1.0
|
CG
|
C:ASP10
|
3.1
|
18.0
|
1.0
|
CG
|
C:ASP19
|
3.2
|
9.7
|
1.0
|
CD
|
C:GLU8
|
3.3
|
14.2
|
1.0
|
CE1
|
C:HIS24
|
3.4
|
9.4
|
1.0
|
CD2
|
C:HIS24
|
3.4
|
12.7
|
1.0
|
CB
|
C:ASP10
|
3.5
|
15.0
|
1.0
|
OE1
|
C:GLU8
|
3.5
|
13.9
|
1.0
|
OD2
|
C:ASP19
|
3.6
|
9.1
|
1.0
|
O
|
C:HOH249
|
3.9
|
4.0
|
1.0
|
OG
|
C:SER34
|
4.1
|
7.2
|
1.0
|
OD1
|
C:ASP10
|
4.2
|
21.0
|
1.0
|
CA
|
C:CA239
|
4.3
|
16.4
|
1.0
|
CB
|
C:ASP19
|
4.4
|
16.4
|
1.0
|
ND1
|
C:HIS24
|
4.5
|
13.2
|
1.0
|
CG
|
C:HIS24
|
4.6
|
15.4
|
1.0
|
O
|
C:VAL32
|
4.6
|
11.2
|
1.0
|
CG
|
C:GLU8
|
4.6
|
10.1
|
1.0
|
CA
|
C:ASP19
|
4.7
|
20.1
|
1.0
|
CD
|
C:PRO20
|
4.8
|
24.7
|
1.0
|
CA
|
C:ASP10
|
5.0
|
11.4
|
1.0
|
|
Manganese binding site 4 out
of 4 in 1cvn
Go back to
Manganese Binding Sites List in 1cvn
Manganese binding site 4 out
of 4 in the Concanavalin A Complexed to Trimannoside
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Concanavalin A Complexed to Trimannoside within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mn238
b:14.8
occ:1.00
|
OD2
|
D:ASP10
|
2.0
|
6.4
|
1.0
|
O
|
D:HOH256
|
2.1
|
2.4
|
1.0
|
OE2
|
D:GLU8
|
2.2
|
12.1
|
1.0
|
O
|
D:HOH244
|
2.2
|
4.8
|
1.0
|
OD1
|
D:ASP19
|
2.4
|
16.3
|
1.0
|
NE2
|
D:HIS24
|
2.5
|
4.5
|
1.0
|
CG
|
D:ASP10
|
3.0
|
5.6
|
1.0
|
CG
|
D:ASP19
|
3.2
|
10.7
|
1.0
|
CD
|
D:GLU8
|
3.2
|
13.6
|
1.0
|
CE1
|
D:HIS24
|
3.4
|
2.0
|
1.0
|
CD2
|
D:HIS24
|
3.4
|
5.5
|
1.0
|
OD2
|
D:ASP19
|
3.4
|
13.2
|
1.0
|
CB
|
D:ASP10
|
3.5
|
9.6
|
1.0
|
OE1
|
D:GLU8
|
3.5
|
15.8
|
1.0
|
O
|
D:HOH255
|
3.8
|
11.5
|
1.0
|
OD1
|
D:ASP10
|
4.1
|
2.0
|
1.0
|
OG
|
D:SER34
|
4.2
|
3.9
|
1.0
|
CA
|
D:CA239
|
4.2
|
7.5
|
1.0
|
CB
|
D:ASP19
|
4.4
|
11.5
|
1.0
|
O
|
D:HOH264
|
4.5
|
16.8
|
1.0
|
ND1
|
D:HIS24
|
4.5
|
7.8
|
1.0
|
CG
|
D:GLU8
|
4.5
|
7.7
|
1.0
|
CG
|
D:HIS24
|
4.5
|
10.3
|
1.0
|
O
|
D:VAL32
|
4.6
|
12.1
|
1.0
|
CA
|
D:ASP19
|
4.8
|
12.5
|
1.0
|
CD
|
D:PRO20
|
4.9
|
15.9
|
1.0
|
CA
|
D:ASP10
|
5.0
|
8.6
|
1.0
|
|
Reference:
J.H.Naismith,
R.A.Field.
Structural Basis of Trimannoside Recognition By Concanavalin A. J.Biol.Chem. V. 271 972 1996.
ISSN: ISSN 0021-9258
PubMed: 8557713
DOI: 10.1074/JBC.271.2.972
Page generated: Sat Oct 5 10:02:32 2024
|