Manganese in PDB 2ffl: Crystal Structure of Dicer From Giardia Intestinalis
Enzymatic activity of Crystal Structure of Dicer From Giardia Intestinalis
All present enzymatic activity of Crystal Structure of Dicer From Giardia Intestinalis:
3.1.26.3;
Protein crystallography data
The structure of Crystal Structure of Dicer From Giardia Intestinalis, PDB code: 2ffl
was solved by
J.A.Doudna,
I.J.Macrae,
P.D.Adams,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
3.33
|
Space group
|
P 21 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
155.515,
174.101,
152.910,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
24.3 /
27.5
|
Manganese Binding Sites:
Manganese binding site 1 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 1 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5001
b:34.2
occ:1.00
|
OE2
|
A:GLU649
|
2.2
|
31.9
|
1.0
|
OD1
|
A:ASP720
|
2.2
|
32.6
|
1.0
|
OE1
|
A:GLU723
|
2.3
|
28.2
|
1.0
|
CD
|
A:GLU723
|
3.1
|
28.1
|
1.0
|
CG
|
A:ASP720
|
3.2
|
31.6
|
1.0
|
OE2
|
A:GLU723
|
3.3
|
29.3
|
1.0
|
CD
|
A:GLU649
|
3.3
|
30.1
|
1.0
|
OD2
|
A:ASP653
|
3.6
|
30.4
|
1.0
|
OD2
|
A:ASP720
|
3.7
|
33.1
|
1.0
|
CG
|
A:GLU649
|
3.9
|
27.6
|
1.0
|
OE1
|
A:GLU649
|
4.2
|
30.1
|
1.0
|
CB
|
A:ASP720
|
4.3
|
30.6
|
1.0
|
CA
|
A:ASP720
|
4.6
|
30.4
|
1.0
|
CG
|
A:GLU723
|
4.6
|
26.6
|
1.0
|
CG
|
A:ASP653
|
4.7
|
28.4
|
1.0
|
ND2
|
A:ASN686
|
4.8
|
36.8
|
1.0
|
|
Manganese binding site 2 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 2 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5002
b:21.9
occ:1.00
|
OE1
|
A:GLU407
|
2.0
|
28.4
|
1.0
|
OE1
|
A:GLU336
|
2.2
|
31.1
|
1.0
|
O
|
A:HOH5039
|
2.5
|
8.8
|
1.0
|
CD
|
A:GLU407
|
3.0
|
28.2
|
1.0
|
OD2
|
A:ASP404
|
3.2
|
32.9
|
1.0
|
OE2
|
A:GLU407
|
3.4
|
29.2
|
1.0
|
CD
|
A:GLU336
|
3.5
|
30.5
|
1.0
|
OD2
|
A:ASP340
|
3.5
|
33.1
|
1.0
|
CG
|
A:ASP404
|
4.0
|
31.4
|
1.0
|
CG
|
A:GLU336
|
4.2
|
27.1
|
1.0
|
CG
|
A:GLU407
|
4.4
|
27.1
|
1.0
|
OE2
|
A:GLU336
|
4.4
|
32.5
|
1.0
|
CG
|
A:ASP340
|
4.5
|
31.0
|
1.0
|
OD1
|
A:ASP404
|
4.7
|
33.2
|
1.0
|
CB
|
A:ASP340
|
4.8
|
28.6
|
1.0
|
CG
|
B:GLU374
|
4.8
|
31.8
|
1.0
|
CD
|
B:GLU374
|
4.9
|
33.9
|
1.0
|
CB
|
A:ASP404
|
4.9
|
30.0
|
1.0
|
CB
|
A:GLU407
|
4.9
|
26.2
|
1.0
|
CA
|
A:ASP404
|
5.0
|
29.7
|
1.0
|
OE2
|
B:GLU374
|
5.0
|
34.0
|
0.5
|
|
Manganese binding site 3 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 3 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5003
b:79.6
occ:1.00
|
OD1
|
A:ASP653
|
2.4
|
30.1
|
1.0
|
OD2
|
A:ASP653
|
2.8
|
30.4
|
1.0
|
CG
|
A:ASP653
|
2.9
|
28.4
|
1.0
|
OE2
|
A:GLU684
|
3.0
|
43.9
|
1.0
|
CD
|
A:GLU684
|
3.4
|
42.9
|
1.0
|
OE2
|
A:GLU723
|
3.7
|
29.3
|
1.0
|
CG
|
A:GLU684
|
3.7
|
41.0
|
1.0
|
O
|
A:GLU684
|
4.0
|
38.4
|
1.0
|
OE1
|
A:GLU684
|
4.1
|
44.6
|
1.0
|
CB
|
A:ASP653
|
4.3
|
26.2
|
1.0
|
O
|
A:ASP653
|
4.6
|
25.7
|
1.0
|
CA
|
A:ASP653
|
4.7
|
25.6
|
1.0
|
CD
|
A:GLU723
|
4.7
|
28.1
|
1.0
|
CB
|
A:GLU684
|
4.8
|
38.6
|
1.0
|
C
|
A:GLU684
|
5.0
|
38.4
|
1.0
|
C
|
A:ASP653
|
5.0
|
25.5
|
1.0
|
|
Manganese binding site 4 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 4 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5004
b:70.5
occ:1.00
|
OE1
|
A:GLU673
|
3.0
|
43.9
|
1.0
|
OE2
|
A:GLU336
|
3.5
|
32.5
|
1.0
|
OE2
|
A:GLU673
|
3.6
|
42.7
|
1.0
|
CD
|
A:GLU673
|
3.7
|
41.0
|
1.0
|
O
|
A:HOH5039
|
3.8
|
8.8
|
1.0
|
OD1
|
A:ASP404
|
4.0
|
33.2
|
1.0
|
CD
|
A:GLU336
|
4.3
|
30.5
|
1.0
|
OE1
|
A:GLU336
|
4.3
|
31.1
|
1.0
|
CG
|
A:ASP404
|
4.9
|
31.4
|
1.0
|
OG
|
A:SER399
|
5.0
|
35.6
|
1.0
|
|
Manganese binding site 5 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 5 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 5 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5005
b:51.4
occ:1.00
|
NE2
|
A:HIS92
|
2.6
|
41.3
|
1.0
|
CE1
|
A:HIS92
|
3.5
|
41.7
|
1.0
|
CD2
|
A:HIS92
|
3.6
|
40.6
|
1.0
|
CG2
|
A:ILE101
|
4.6
|
51.5
|
1.0
|
OD1
|
A:ASN103
|
4.6
|
60.2
|
1.0
|
ND1
|
A:HIS92
|
4.6
|
41.5
|
1.0
|
CG
|
A:HIS92
|
4.7
|
40.3
|
1.0
|
|
Manganese binding site 6 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 6 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 6 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5006
b:36.1
occ:1.00
|
NE2
|
A:HIS513
|
2.5
|
48.2
|
1.0
|
CD2
|
A:HIS513
|
3.5
|
47.0
|
1.0
|
CE1
|
A:HIS513
|
3.5
|
48.4
|
1.0
|
OE1
|
D:GLU702
|
4.2
|
61.6
|
1.0
|
OE2
|
D:GLU702
|
4.6
|
60.7
|
1.0
|
ND1
|
A:HIS513
|
4.6
|
47.6
|
1.0
|
CG
|
A:HIS513
|
4.6
|
45.9
|
1.0
|
CD
|
D:GLU702
|
4.8
|
60.6
|
1.0
|
|
Manganese binding site 7 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 7 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 7 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5013
b:74.2
occ:1.00
|
OD2
|
B:ASP714
|
2.1
|
57.4
|
1.0
|
OD1
|
A:ASP495
|
2.4
|
42.2
|
1.0
|
OE2
|
A:GLU491
|
2.8
|
40.9
|
1.0
|
CG
|
B:ASP714
|
2.8
|
57.5
|
1.0
|
OD1
|
B:ASP714
|
3.0
|
59.2
|
1.0
|
CG
|
A:ASP495
|
3.3
|
40.6
|
1.0
|
OD2
|
A:ASP495
|
3.6
|
40.6
|
1.0
|
CD
|
A:GLU491
|
3.7
|
41.2
|
1.0
|
OE1
|
A:GLU491
|
3.8
|
42.9
|
1.0
|
O
|
B:ASP714
|
4.1
|
54.0
|
1.0
|
CB
|
B:ASP714
|
4.2
|
56.6
|
1.0
|
C
|
B:ASP714
|
4.6
|
54.3
|
1.0
|
CB
|
A:ASP495
|
4.7
|
39.5
|
1.0
|
|
Manganese binding site 8 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 8 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 8 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5026
b:64.9
occ:1.00
|
NE2
|
A:HIS204
|
2.2
|
56.0
|
1.0
|
CE1
|
A:HIS204
|
3.1
|
55.9
|
1.0
|
OD1
|
A:ASN202
|
3.1
|
57.1
|
1.0
|
CD2
|
A:HIS204
|
3.4
|
56.1
|
1.0
|
CG
|
A:ASN202
|
3.6
|
56.2
|
1.0
|
ND2
|
A:ASN202
|
3.7
|
57.1
|
1.0
|
ND1
|
A:HIS204
|
4.3
|
55.8
|
1.0
|
CG
|
A:HIS204
|
4.4
|
55.7
|
1.0
|
CB
|
A:ASN202
|
4.8
|
55.4
|
1.0
|
CA
|
A:ASN202
|
4.8
|
55.0
|
1.0
|
O
|
A:ASN202
|
4.9
|
55.0
|
1.0
|
|
Manganese binding site 9 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 9 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 9 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5027
b:52.1
occ:1.00
|
NH1
|
A:ARG334
|
3.2
|
26.9
|
1.0
|
NE2
|
A:HIS665
|
3.2
|
27.2
|
1.0
|
CE1
|
A:HIS665
|
3.4
|
27.8
|
1.0
|
CD2
|
A:LEU335
|
4.3
|
23.9
|
1.0
|
CD2
|
A:HIS665
|
4.4
|
26.8
|
1.0
|
CZ
|
A:ARG334
|
4.4
|
26.3
|
1.0
|
ND1
|
A:HIS665
|
4.6
|
27.1
|
1.0
|
CG
|
A:LEU335
|
4.7
|
24.7
|
1.0
|
CG1
|
A:VAL331
|
4.8
|
25.6
|
1.0
|
CG
|
A:ARG334
|
4.9
|
25.5
|
1.0
|
|
Manganese binding site 10 out
of 39 in 2ffl
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Manganese Binding Sites List in 2ffl
Manganese binding site 10 out
of 39 in the Crystal Structure of Dicer From Giardia Intestinalis
 Mono view
 Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 10 of Crystal Structure of Dicer From Giardia Intestinalis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn5029
b:67.0
occ:1.00
|
OG1
|
A:THR670
|
2.9
|
30.8
|
1.0
|
N
|
A:THR670
|
3.1
|
30.5
|
1.0
|
CG2
|
A:THR670
|
3.4
|
30.9
|
1.0
|
C
|
A:HIS668
|
3.4
|
30.0
|
1.0
|
N
|
A:PRO669
|
3.4
|
30.1
|
1.0
|
CB
|
A:THR670
|
3.5
|
30.7
|
1.0
|
CD
|
A:PRO669
|
3.6
|
30.0
|
1.0
|
CA
|
A:HIS668
|
3.6
|
29.8
|
1.0
|
CA
|
A:THR670
|
3.8
|
30.9
|
1.0
|
CG
|
A:PRO669
|
3.8
|
30.1
|
1.0
|
O
|
A:HIS668
|
4.0
|
30.3
|
1.0
|
C
|
A:PRO669
|
4.1
|
30.4
|
1.0
|
CB
|
A:HIS668
|
4.1
|
29.7
|
1.0
|
N
|
A:LEU671
|
4.2
|
31.9
|
1.0
|
CA
|
A:PRO669
|
4.2
|
30.3
|
1.0
|
CG
|
A:LEU671
|
4.3
|
31.9
|
1.0
|
CD2
|
A:LEU671
|
4.3
|
31.9
|
1.0
|
C
|
A:THR670
|
4.3
|
31.3
|
1.0
|
CB
|
A:PRO669
|
4.6
|
30.3
|
1.0
|
ND1
|
A:HIS668
|
4.6
|
31.8
|
1.0
|
O
|
A:LEU667
|
4.7
|
30.0
|
1.0
|
N
|
A:HIS668
|
4.8
|
29.5
|
1.0
|
CG
|
A:HIS668
|
4.9
|
30.6
|
1.0
|
|
Reference:
I.J.Macrae,
K.Zhou,
F.Li,
A.Repic,
A.N.Brooks,
W.Z.Cande,
P.D.Adams,
J.A.Doudna.
Structural Basis of Double-Stranded Rna Processing By Dicer Science V. 311 195 2006.
ISSN: ISSN 0036-8075
PubMed: 16410517
DOI: 10.1126/SCIENCE.1121638
Page generated: Sat Oct 5 14:08:14 2024
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