Zinc in PDB 3no5: Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Protein crystallography data
The structure of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution, PDB code: 3no5
was solved by
Joint Center For Structural Genomics (Jcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.96 /
1.90
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
83.181,
81.221,
140.429,
90.00,
103.68,
90.00
|
R / Rfree (%)
|
20.6 /
22.4
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
(pdb code 3no5). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 6 binding sites of Zinc where determined in the
Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution, PDB code: 3no5:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
Zinc binding site 1 out
of 6 in 3no5
Go back to
Zinc Binding Sites List in 3no5
Zinc binding site 1 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn275
b:27.5
occ:1.00
|
OE2
|
A:GLU229
|
2.1
|
29.0
|
1.0
|
NE2
|
A:HIS49
|
2.1
|
26.3
|
1.0
|
O
|
A:HOH701
|
2.1
|
20.1
|
1.0
|
O
|
A:HOH1049
|
2.1
|
21.3
|
1.0
|
NE2
|
A:HIS47
|
2.1
|
25.8
|
1.0
|
O
|
A:HOH616
|
2.2
|
22.4
|
1.0
|
CD2
|
A:HIS49
|
3.1
|
27.1
|
1.0
|
CD
|
A:GLU229
|
3.1
|
39.3
|
1.0
|
CD2
|
A:HIS47
|
3.1
|
26.4
|
1.0
|
CE1
|
A:HIS47
|
3.1
|
24.8
|
1.0
|
CE1
|
A:HIS49
|
3.2
|
26.7
|
1.0
|
OE1
|
A:GLU229
|
3.4
|
24.5
|
1.0
|
O
|
A:HOH1352
|
3.8
|
40.7
|
1.0
|
OG
|
A:SER83
|
3.9
|
32.2
|
1.0
|
NH2
|
A:ARG225
|
4.1
|
23.1
|
1.0
|
O
|
A:HOH1048
|
4.2
|
31.4
|
1.0
|
CG
|
A:HIS49
|
4.2
|
26.4
|
1.0
|
CG
|
A:HIS47
|
4.2
|
24.2
|
1.0
|
ND1
|
A:HIS47
|
4.2
|
25.2
|
1.0
|
ND1
|
A:HIS49
|
4.3
|
28.0
|
1.0
|
CB
|
A:SER83
|
4.3
|
24.7
|
1.0
|
O
|
A:HOH1350
|
4.4
|
39.1
|
1.0
|
CG
|
A:GLU229
|
4.4
|
32.1
|
1.0
|
NH1
|
A:ARG225
|
4.5
|
25.1
|
1.0
|
O
|
A:HOH1084
|
4.7
|
50.1
|
1.0
|
CZ
|
A:ARG225
|
4.8
|
39.2
|
1.0
|
|
Zinc binding site 2 out
of 6 in 3no5
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Zinc Binding Sites List in 3no5
Zinc binding site 2 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn275
b:31.9
occ:1.00
|
NE2
|
B:HIS47
|
2.1
|
28.6
|
1.0
|
OE2
|
B:GLU229
|
2.1
|
28.4
|
1.0
|
NE2
|
B:HIS49
|
2.2
|
30.5
|
1.0
|
O
|
B:HOH867
|
2.2
|
24.6
|
1.0
|
O
|
B:HOH1015
|
2.3
|
23.5
|
1.0
|
O
|
B:HOH1223
|
2.4
|
36.7
|
1.0
|
CE1
|
B:HIS47
|
3.1
|
28.0
|
1.0
|
CD2
|
B:HIS49
|
3.1
|
31.4
|
1.0
|
CD2
|
B:HIS47
|
3.1
|
29.0
|
1.0
|
CD
|
B:GLU229
|
3.1
|
38.8
|
1.0
|
CE1
|
B:HIS49
|
3.2
|
30.8
|
1.0
|
OE1
|
B:GLU229
|
3.5
|
26.9
|
1.0
|
OG
|
B:SER83
|
3.9
|
35.1
|
1.0
|
NH2
|
B:ARG225
|
4.1
|
25.7
|
1.0
|
O
|
B:HOH1226
|
4.1
|
42.9
|
1.0
|
ND1
|
B:HIS47
|
4.2
|
28.5
|
1.0
|
CG
|
B:HIS47
|
4.2
|
27.0
|
1.0
|
CG
|
B:HIS49
|
4.3
|
31.3
|
1.0
|
CB
|
B:SER83
|
4.3
|
30.4
|
1.0
|
ND1
|
B:HIS49
|
4.3
|
32.8
|
1.0
|
CG
|
B:GLU229
|
4.5
|
27.6
|
1.0
|
NH1
|
B:ARG225
|
4.5
|
26.8
|
1.0
|
CZ
|
B:ARG225
|
4.8
|
39.5
|
1.0
|
|
Zinc binding site 3 out
of 6 in 3no5
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Zinc Binding Sites List in 3no5
Zinc binding site 3 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn275
b:22.8
occ:1.00
|
OE2
|
C:GLU229
|
2.1
|
17.0
|
1.0
|
NE2
|
C:HIS47
|
2.1
|
15.5
|
1.0
|
NE2
|
C:HIS49
|
2.1
|
19.8
|
1.0
|
O
|
C:HOH936
|
2.2
|
12.5
|
1.0
|
OXT
|
C:ACT286
|
2.3
|
29.0
|
1.0
|
O1
|
C:EDO276
|
2.9
|
36.5
|
1.0
|
CD2
|
C:HIS49
|
3.1
|
20.5
|
1.0
|
CD
|
C:GLU229
|
3.1
|
25.7
|
1.0
|
CD2
|
C:HIS47
|
3.1
|
16.5
|
1.0
|
CE1
|
C:HIS47
|
3.1
|
15.4
|
1.0
|
CE1
|
C:HIS49
|
3.2
|
19.6
|
1.0
|
C
|
C:ACT286
|
3.3
|
30.7
|
1.0
|
C1
|
C:EDO276
|
3.4
|
37.3
|
1.0
|
OE1
|
C:GLU229
|
3.4
|
15.4
|
1.0
|
O
|
C:ACT286
|
3.6
|
31.3
|
1.0
|
O2
|
C:EDO281
|
4.0
|
44.9
|
1.0
|
OG
|
C:SER83
|
4.0
|
20.2
|
1.0
|
NH2
|
C:ARG225
|
4.1
|
14.8
|
1.0
|
CG
|
C:HIS47
|
4.2
|
16.0
|
1.0
|
CG
|
C:HIS49
|
4.2
|
19.2
|
1.0
|
ND1
|
C:HIS47
|
4.2
|
17.1
|
1.0
|
ND1
|
C:HIS49
|
4.3
|
20.7
|
1.0
|
CB
|
C:SER83
|
4.4
|
16.8
|
1.0
|
CG
|
C:GLU229
|
4.4
|
20.5
|
1.0
|
NH1
|
C:ARG225
|
4.5
|
16.6
|
1.0
|
O
|
C:HOH1031
|
4.6
|
39.5
|
1.0
|
C2
|
C:EDO276
|
4.6
|
37.2
|
1.0
|
CH3
|
C:ACT286
|
4.7
|
30.6
|
1.0
|
CZ
|
C:ARG225
|
4.8
|
28.5
|
1.0
|
|
Zinc binding site 4 out
of 6 in 3no5
Go back to
Zinc Binding Sites List in 3no5
Zinc binding site 4 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn275
b:22.1
occ:1.00
|
OE2
|
D:GLU229
|
2.1
|
14.0
|
1.0
|
NE2
|
D:HIS47
|
2.1
|
17.8
|
1.0
|
NE2
|
D:HIS49
|
2.2
|
16.8
|
1.0
|
O2
|
D:EDO277
|
2.2
|
22.0
|
1.0
|
O
|
D:HOH606
|
2.2
|
21.9
|
1.0
|
OXT
|
D:ACT287
|
2.6
|
37.0
|
1.0
|
CD
|
D:GLU229
|
3.1
|
25.8
|
1.0
|
CD2
|
D:HIS49
|
3.1
|
17.4
|
1.0
|
CD2
|
D:HIS47
|
3.1
|
18.6
|
1.0
|
CE1
|
D:HIS47
|
3.1
|
17.5
|
1.0
|
CE1
|
D:HIS49
|
3.2
|
16.7
|
1.0
|
OE1
|
D:GLU229
|
3.4
|
16.9
|
1.0
|
C2
|
D:EDO277
|
3.5
|
22.9
|
1.0
|
C
|
D:ACT287
|
3.8
|
38.1
|
1.0
|
C1
|
D:EDO277
|
3.8
|
26.3
|
1.0
|
O1
|
D:EDO277
|
3.9
|
29.2
|
1.0
|
OG
|
D:SER83
|
4.0
|
14.4
|
1.0
|
NH2
|
D:ARG225
|
4.0
|
10.9
|
1.0
|
CG
|
D:HIS47
|
4.2
|
17.1
|
1.0
|
ND1
|
D:HIS47
|
4.2
|
18.4
|
1.0
|
CG
|
D:HIS49
|
4.2
|
16.3
|
1.0
|
ND1
|
D:HIS49
|
4.3
|
18.0
|
1.0
|
CB
|
D:SER83
|
4.4
|
14.4
|
1.0
|
CG
|
D:GLU229
|
4.4
|
17.3
|
1.0
|
O
|
D:HOH653
|
4.4
|
36.5
|
1.0
|
CH3
|
D:ACT287
|
4.4
|
38.0
|
1.0
|
NH1
|
D:ARG225
|
4.4
|
14.1
|
1.0
|
C1
|
D:EDO284
|
4.7
|
36.1
|
1.0
|
CZ
|
D:ARG225
|
4.7
|
23.2
|
1.0
|
O
|
D:ACT287
|
4.8
|
37.4
|
1.0
|
O1
|
D:EDO284
|
4.8
|
37.6
|
1.0
|
|
Zinc binding site 5 out
of 6 in 3no5
Go back to
Zinc Binding Sites List in 3no5
Zinc binding site 5 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Zn275
b:21.9
occ:1.00
|
NE2
|
E:HIS47
|
2.1
|
16.5
|
1.0
|
OE2
|
E:GLU229
|
2.1
|
19.3
|
1.0
|
O
|
E:HOH1043
|
2.1
|
20.0
|
1.0
|
NE2
|
E:HIS49
|
2.1
|
20.2
|
1.0
|
O
|
E:HOH1156
|
2.6
|
31.6
|
1.0
|
O
|
E:HOH667
|
2.7
|
24.1
|
1.0
|
CD2
|
E:HIS49
|
3.0
|
20.7
|
1.0
|
CD2
|
E:HIS47
|
3.1
|
16.5
|
1.0
|
CE1
|
E:HIS47
|
3.1
|
16.1
|
1.0
|
CD
|
E:GLU229
|
3.1
|
29.7
|
1.0
|
CE1
|
E:HIS49
|
3.2
|
20.4
|
1.0
|
OE1
|
E:GLU229
|
3.4
|
18.0
|
1.0
|
OG
|
E:SER83
|
3.9
|
25.9
|
1.0
|
NH2
|
E:ARG225
|
4.1
|
19.2
|
1.0
|
O
|
E:HOH555
|
4.1
|
26.5
|
1.0
|
CG
|
E:HIS47
|
4.2
|
15.3
|
1.0
|
ND1
|
E:HIS47
|
4.2
|
16.8
|
1.0
|
CG
|
E:HIS49
|
4.2
|
20.0
|
1.0
|
ND1
|
E:HIS49
|
4.3
|
21.9
|
1.0
|
CB
|
E:SER83
|
4.3
|
21.7
|
1.0
|
CG
|
E:GLU229
|
4.4
|
23.4
|
1.0
|
NH1
|
E:ARG225
|
4.5
|
16.0
|
1.0
|
CZ
|
E:ARG225
|
4.8
|
29.6
|
1.0
|
O
|
E:HOH1064
|
5.0
|
28.7
|
1.0
|
|
Zinc binding site 6 out
of 6 in 3no5
Go back to
Zinc Binding Sites List in 3no5
Zinc binding site 6 out
of 6 in the Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Crystal Structure of A Pfam DUF849 Domain Containing Protein (REUT_A1631) From Ralstonia Eutropha JMP134 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Zn275
b:24.5
occ:1.00
|
OE2
|
F:GLU229
|
2.1
|
22.1
|
1.0
|
NE2
|
F:HIS47
|
2.1
|
19.9
|
1.0
|
NE2
|
F:HIS49
|
2.1
|
20.6
|
1.0
|
O
|
F:HOH1046
|
2.2
|
19.2
|
1.0
|
O
|
F:HOH988
|
2.2
|
19.4
|
1.0
|
O
|
F:HOH763
|
2.7
|
32.1
|
1.0
|
CD2
|
F:HIS49
|
3.1
|
21.5
|
1.0
|
CD
|
F:GLU229
|
3.1
|
37.6
|
1.0
|
CD2
|
F:HIS47
|
3.1
|
20.7
|
1.0
|
CE1
|
F:HIS47
|
3.1
|
19.0
|
1.0
|
CE1
|
F:HIS49
|
3.2
|
20.4
|
1.0
|
OE1
|
F:GLU229
|
3.4
|
30.9
|
1.0
|
OG
|
F:SER83
|
3.9
|
21.2
|
1.0
|
O
|
F:HOH1030
|
4.0
|
31.5
|
1.0
|
NH2
|
F:ARG225
|
4.1
|
21.1
|
1.0
|
CG
|
F:HIS47
|
4.2
|
19.0
|
1.0
|
CG
|
F:HIS49
|
4.2
|
20.4
|
1.0
|
ND1
|
F:HIS47
|
4.2
|
19.9
|
1.0
|
ND1
|
F:HIS49
|
4.3
|
21.9
|
1.0
|
CB
|
F:SER83
|
4.3
|
17.6
|
1.0
|
CG
|
F:GLU229
|
4.4
|
24.9
|
1.0
|
NH1
|
F:ARG225
|
4.5
|
23.1
|
1.0
|
CZ
|
F:ARG225
|
4.8
|
37.1
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
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