Mercury in PDB 4r14: Crystal Structure of Human CSN6 Mpn Domain
Protein crystallography data
The structure of Crystal Structure of Human CSN6 Mpn Domain, PDB code: 4r14
was solved by
T.Jiang,
M.Xu,
X.L.Ma,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
34.68 /
2.60
|
Space group
|
P 32
|
Cell size a, b, c (Å), α, β, γ (°)
|
66.552,
66.552,
86.829,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
22.5 /
25.9
|
Mercury Binding Sites:
The binding sites of Mercury atom in the Crystal Structure of Human CSN6 Mpn Domain
(pdb code 4r14). This binding sites where shown within
5.0 Angstroms radius around Mercury atom.
In total 8 binding sites of Mercury where determined in the
Crystal Structure of Human CSN6 Mpn Domain, PDB code: 4r14:
Jump to Mercury binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Mercury binding site 1 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 1 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 1 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Hg301
b:65.5
occ:0.23
|
SG
|
A:CYS143
|
2.5
|
92.7
|
1.0
|
O
|
A:GLU147
|
3.1
|
72.5
|
1.0
|
CB
|
A:CYS143
|
3.5
|
39.5
|
1.0
|
CD
|
A:PRO149
|
3.6
|
68.3
|
1.0
|
CA
|
A:SER148
|
4.2
|
59.5
|
1.0
|
C
|
A:GLU147
|
4.2
|
70.3
|
1.0
|
NE2
|
A:HIS139
|
4.4
|
40.0
|
1.0
|
CA
|
A:CYS143
|
4.4
|
38.5
|
1.0
|
CG
|
A:PRO149
|
4.4
|
65.6
|
1.0
|
CD2
|
A:HIS139
|
4.6
|
38.4
|
1.0
|
OG
|
A:SER148
|
4.6
|
63.3
|
1.0
|
N
|
A:PRO149
|
4.6
|
67.1
|
1.0
|
N
|
A:SER148
|
4.7
|
46.0
|
1.0
|
C
|
A:SER148
|
4.9
|
57.6
|
1.0
|
CB
|
A:SER148
|
4.9
|
48.6
|
1.0
|
HG
|
A:HG302
|
5.0
|
60.5
|
0.3
|
|
Mercury binding site 2 out
of 8 in 4r14
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Mercury Binding Sites List in 4r14
Mercury binding site 2 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 2 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Hg302
b:60.5
occ:0.26
|
SG
|
A:CYS143
|
2.5
|
92.7
|
1.0
|
O
|
A:CYS143
|
3.0
|
54.2
|
1.0
|
CB
|
A:CYS143
|
3.1
|
39.5
|
1.0
|
C
|
A:CYS143
|
3.2
|
48.7
|
1.0
|
CA
|
A:CYS143
|
3.8
|
38.5
|
1.0
|
N
|
A:GLU144
|
3.8
|
37.7
|
1.0
|
O
|
A:LYS140
|
4.0
|
46.4
|
1.0
|
CA
|
A:GLU144
|
4.2
|
44.3
|
1.0
|
CG
|
A:GLU144
|
4.3
|
57.0
|
1.0
|
CB
|
A:GLU144
|
4.8
|
47.5
|
1.0
|
N
|
A:CYS143
|
4.9
|
36.5
|
1.0
|
HG
|
A:HG301
|
5.0
|
65.5
|
0.2
|
|
Mercury binding site 3 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 3 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 3 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Hg303
b:35.9
occ:0.17
|
NE2
|
A:HIS54
|
2.7
|
22.4
|
1.0
|
CE1
|
A:HIS54
|
3.4
|
27.8
|
1.0
|
OE1
|
A:GLU88
|
3.6
|
60.9
|
1.0
|
CD2
|
A:HIS54
|
3.8
|
25.4
|
1.0
|
CG
|
A:GLU88
|
3.8
|
61.3
|
1.0
|
SD
|
A:MET58
|
4.1
|
35.8
|
1.0
|
CD
|
A:GLU88
|
4.2
|
71.8
|
1.0
|
CB
|
A:GLU88
|
4.5
|
35.2
|
1.0
|
O
|
A:LEU89
|
4.5
|
23.5
|
1.0
|
CG
|
A:MET58
|
4.5
|
23.1
|
1.0
|
ND1
|
A:HIS54
|
4.6
|
23.3
|
1.0
|
CG
|
A:HIS54
|
4.8
|
22.9
|
1.0
|
CE
|
A:MET58
|
4.8
|
23.4
|
1.0
|
O
|
A:ILE69
|
5.0
|
24.1
|
1.0
|
|
Mercury binding site 4 out
of 8 in 4r14
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Mercury Binding Sites List in 4r14
Mercury binding site 4 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 4 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Hg304
b:39.8
occ:0.12
|
O
|
A:LEU119
|
2.9
|
66.6
|
1.0
|
O
|
A:PHE116
|
3.3
|
52.2
|
1.0
|
C
|
A:LEU119
|
3.7
|
57.1
|
1.0
|
CB
|
A:PHE116
|
3.9
|
53.5
|
1.0
|
CA
|
A:GLU120
|
4.0
|
43.1
|
1.0
|
N
|
A:GLU120
|
4.1
|
48.5
|
1.0
|
C
|
A:PHE116
|
4.3
|
56.4
|
1.0
|
C
|
A:GLU120
|
4.5
|
44.9
|
1.0
|
N
|
A:PHE121
|
4.6
|
41.5
|
1.0
|
CA
|
A:LEU119
|
4.8
|
57.0
|
1.0
|
OE1
|
A:GLU109
|
4.8
|
47.7
|
1.0
|
CA
|
A:PHE116
|
4.8
|
55.3
|
1.0
|
CG
|
A:PHE116
|
4.8
|
52.6
|
1.0
|
CD2
|
A:PHE116
|
4.9
|
46.4
|
1.0
|
CB
|
A:LEU119
|
4.9
|
46.4
|
1.0
|
|
Mercury binding site 5 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 5 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 5 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Hg301
b:51.9
occ:0.19
|
SG
|
B:CYS143
|
2.5
|
98.2
|
1.0
|
O
|
B:GLU147
|
3.1
|
66.8
|
1.0
|
CD
|
B:PRO149
|
3.4
|
66.2
|
1.0
|
CB
|
B:CYS143
|
3.5
|
38.7
|
1.0
|
CA
|
B:SER148
|
4.2
|
63.7
|
1.0
|
C
|
B:GLU147
|
4.2
|
70.0
|
1.0
|
CG
|
B:PRO149
|
4.3
|
63.8
|
1.0
|
NE2
|
B:HIS139
|
4.3
|
43.8
|
1.0
|
CA
|
B:CYS143
|
4.4
|
37.7
|
1.0
|
CD2
|
B:HIS139
|
4.5
|
37.5
|
1.0
|
N
|
B:PRO149
|
4.6
|
65.3
|
1.0
|
N
|
B:SER148
|
4.7
|
45.2
|
1.0
|
OG
|
B:SER148
|
4.8
|
60.9
|
1.0
|
C
|
B:SER148
|
4.9
|
59.2
|
1.0
|
HG
|
B:HG302
|
5.0
|
55.2
|
0.2
|
|
Mercury binding site 6 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 6 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 6 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Hg302
b:55.2
occ:0.23
|
SG
|
B:CYS143
|
2.5
|
98.2
|
1.0
|
O
|
B:CYS143
|
3.1
|
44.3
|
1.0
|
CB
|
B:CYS143
|
3.1
|
38.7
|
1.0
|
C
|
B:CYS143
|
3.3
|
38.2
|
1.0
|
CA
|
B:CYS143
|
3.8
|
37.7
|
1.0
|
N
|
B:GLU144
|
3.8
|
40.1
|
1.0
|
O
|
B:LYS140
|
3.9
|
48.4
|
1.0
|
CA
|
B:GLU144
|
4.3
|
38.6
|
1.0
|
CG
|
B:GLU144
|
4.4
|
53.4
|
1.0
|
N
|
B:CYS143
|
4.9
|
35.7
|
1.0
|
CB
|
B:GLU144
|
4.9
|
46.1
|
1.0
|
C
|
B:LYS140
|
5.0
|
41.4
|
1.0
|
HG
|
B:HG301
|
5.0
|
51.9
|
0.2
|
|
Mercury binding site 7 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 7 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 7 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Hg303
b:34.5
occ:0.18
|
NE2
|
B:HIS54
|
2.6
|
22.5
|
1.0
|
CE1
|
B:HIS54
|
3.4
|
23.8
|
1.0
|
CD2
|
B:HIS54
|
3.7
|
26.6
|
1.0
|
OE1
|
B:GLU88
|
3.7
|
62.0
|
1.0
|
CG
|
B:GLU88
|
4.0
|
63.1
|
1.0
|
SD
|
B:MET58
|
4.1
|
35.5
|
1.0
|
CD
|
B:GLU88
|
4.3
|
73.4
|
1.0
|
CG
|
B:MET58
|
4.4
|
30.3
|
1.0
|
O
|
B:LEU89
|
4.5
|
23.2
|
1.0
|
CB
|
B:GLU88
|
4.5
|
39.0
|
1.0
|
ND1
|
B:HIS54
|
4.6
|
25.1
|
1.0
|
CG
|
B:HIS54
|
4.8
|
22.8
|
1.0
|
CE
|
B:MET58
|
4.8
|
24.9
|
1.0
|
O
|
B:ILE69
|
4.9
|
23.8
|
1.0
|
CG1
|
B:VAL68
|
5.0
|
22.7
|
1.0
|
|
Mercury binding site 8 out
of 8 in 4r14
Go back to
Mercury Binding Sites List in 4r14
Mercury binding site 8 out
of 8 in the Crystal Structure of Human CSN6 Mpn Domain
Mono view
Stereo pair view
|
A full contact list of Mercury with other atoms in the Hg binding
site number 8 of Crystal Structure of Human CSN6 Mpn Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Hg304
b:39.4
occ:0.13
|
O
|
B:LEU119
|
3.0
|
70.9
|
1.0
|
O
|
B:PHE116
|
3.3
|
52.8
|
1.0
|
C
|
B:LEU119
|
3.7
|
66.5
|
1.0
|
CB
|
B:PHE116
|
3.9
|
57.5
|
1.0
|
CA
|
B:GLU120
|
3.9
|
42.8
|
1.0
|
N
|
B:GLU120
|
4.1
|
43.4
|
1.0
|
C
|
B:PHE116
|
4.3
|
58.8
|
1.0
|
C
|
B:GLU120
|
4.4
|
43.7
|
1.0
|
N
|
B:PHE121
|
4.5
|
45.9
|
1.0
|
OE2
|
B:GLU109
|
4.7
|
49.9
|
1.0
|
CA
|
B:LEU119
|
4.8
|
61.0
|
1.0
|
CA
|
B:PHE116
|
4.8
|
57.5
|
1.0
|
CG
|
B:PHE116
|
4.9
|
50.7
|
1.0
|
CB
|
B:LEU119
|
4.9
|
59.5
|
1.0
|
CD2
|
B:PHE116
|
4.9
|
46.3
|
1.0
|
O
|
B:GLU120
|
5.0
|
42.9
|
1.0
|
|
Reference:
X.L.Ma,
M.Xu,
T.Jiang.
Crystal Structure of the Human CSN6 Mpn Domain Biochem.Biophys.Res.Commun. V. 453 25 2014.
ISSN: ISSN 0006-291X
PubMed: 25242525
DOI: 10.1016/J.BBRC.2014.09.046
Page generated: Sun Aug 11 05:29:29 2024
|