Chlorine in PDB 4mg5: Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Protein crystallography data
The structure of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone, PDB code: 4mg5
was solved by
V.Delfosse,
M.Grimaldi,
W.Bourguet,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
46.36 /
2.05
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
54.700,
81.780,
58.560,
90.00,
110.28,
90.00
|
R / Rfree (%)
|
19.8 /
22.7
|
Chlorine Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
20;
Binding sites:
The binding sites of Chlorine atom in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
(pdb code 4mg5). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 20 binding sites of Chlorine where determined in the
Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone, PDB code: 4mg5:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 1 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:82.5
occ:1.00
|
CLT
|
A:27E602
|
0.0
|
82.5
|
1.0
|
CAB
|
A:27E602
|
1.8
|
75.7
|
1.0
|
CAA
|
A:27E602
|
2.7
|
71.4
|
1.0
|
CAC
|
A:27E602
|
2.9
|
75.1
|
1.0
|
CAG
|
A:27E602
|
2.9
|
72.3
|
1.0
|
OAU
|
A:27E602
|
3.0
|
68.9
|
1.0
|
ND1
|
A:HIS524
|
3.2
|
55.4
|
1.0
|
CAH
|
A:27E602
|
3.3
|
76.4
|
1.0
|
CLS
|
A:27E602
|
3.3
|
66.9
|
1.0
|
CLO
|
A:27E602
|
3.4
|
74.8
|
1.0
|
CE
|
A:MET528
|
3.4
|
55.3
|
1.0
|
CLN
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CAE
|
A:27E602
|
3.9
|
76.8
|
1.0
|
CE1
|
A:HIS524
|
4.0
|
59.6
|
1.0
|
CE
|
A:MET421
|
4.0
|
67.5
|
1.0
|
N
|
A:LEU525
|
4.0
|
39.8
|
1.0
|
CA
|
A:LEU525
|
4.1
|
42.8
|
1.0
|
CAD
|
A:27E602
|
4.1
|
74.8
|
1.0
|
CG
|
A:HIS524
|
4.1
|
56.3
|
1.0
|
CAF
|
A:27E602
|
4.1
|
71.1
|
1.0
|
SD
|
A:MET528
|
4.1
|
78.8
|
1.0
|
CB
|
A:LEU525
|
4.3
|
37.1
|
1.0
|
CD1
|
A:LEU525
|
4.3
|
54.1
|
1.0
|
CB
|
A:HIS524
|
4.3
|
42.2
|
1.0
|
C
|
A:HIS524
|
4.4
|
44.5
|
1.0
|
O
|
A:GLY521
|
4.5
|
33.8
|
1.0
|
SD
|
A:MET343
|
4.6
|
62.6
|
0.1
|
CG
|
A:MET528
|
4.7
|
48.9
|
1.0
|
O
|
A:HIS524
|
4.7
|
39.0
|
1.0
|
CAI
|
A:27E602
|
4.7
|
75.1
|
1.0
|
CAJ
|
A:27E602
|
4.8
|
72.0
|
1.0
|
SD
|
A:MET421
|
4.8
|
86.2
|
1.0
|
CG
|
A:LEU525
|
4.9
|
48.7
|
1.0
|
|
Chlorine binding site 2 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 2 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:66.9
occ:1.00
|
CLS
|
A:27E602
|
0.0
|
66.9
|
1.0
|
CAC
|
A:27E602
|
1.8
|
75.1
|
1.0
|
CAH
|
A:27E602
|
2.9
|
76.4
|
1.0
|
CAB
|
A:27E602
|
2.9
|
75.7
|
1.0
|
CAD
|
A:27E602
|
2.9
|
74.8
|
1.0
|
CLT
|
A:27E602
|
3.3
|
82.5
|
1.0
|
CLN
|
A:27E602
|
3.4
|
82.3
|
1.0
|
CLR
|
A:27E602
|
3.4
|
60.5
|
1.0
|
O
|
A:GLY521
|
3.5
|
33.8
|
1.0
|
CAA
|
A:27E602
|
3.6
|
71.4
|
1.0
|
CD2
|
A:LEU384
|
3.8
|
32.3
|
1.0
|
CAI
|
A:27E602
|
3.8
|
75.1
|
1.0
|
CLL
|
A:27E602
|
3.8
|
72.2
|
1.0
|
CD1
|
A:LEU384
|
3.8
|
36.8
|
1.0
|
CAG
|
A:27E602
|
3.8
|
72.3
|
1.0
|
C
|
A:GLY521
|
3.9
|
35.8
|
1.0
|
CB
|
A:LEU525
|
4.0
|
37.1
|
1.0
|
CAE
|
A:27E602
|
4.0
|
76.8
|
1.0
|
CAJ
|
A:27E602
|
4.0
|
72.0
|
1.0
|
CA
|
A:GLY521
|
4.2
|
27.3
|
1.0
|
OAU
|
A:27E602
|
4.3
|
68.9
|
1.0
|
CD2
|
A:LEU525
|
4.3
|
43.7
|
1.0
|
CG
|
A:LEU384
|
4.4
|
31.1
|
1.0
|
CAF
|
A:27E602
|
4.5
|
71.1
|
1.0
|
CG
|
A:LEU525
|
4.5
|
48.7
|
1.0
|
CD1
|
A:LEU525
|
4.6
|
54.1
|
1.0
|
N
|
A:MET522
|
4.7
|
33.4
|
1.0
|
N
|
A:LEU525
|
4.8
|
39.8
|
1.0
|
CA
|
A:LEU525
|
4.8
|
42.8
|
1.0
|
|
Chlorine binding site 3 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 3 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:82.3
occ:1.00
|
CLN
|
A:27E602
|
0.0
|
82.3
|
1.0
|
CAH
|
A:27E602
|
1.8
|
76.4
|
1.0
|
CAI
|
A:27E602
|
2.8
|
75.1
|
1.0
|
CAG
|
A:27E602
|
2.9
|
72.3
|
1.0
|
CAC
|
A:27E602
|
2.9
|
75.1
|
1.0
|
CAB
|
A:27E602
|
3.3
|
75.7
|
1.0
|
CLS
|
A:27E602
|
3.4
|
66.9
|
1.0
|
CLO
|
A:27E602
|
3.4
|
74.8
|
1.0
|
CLM
|
A:27E602
|
3.5
|
68.2
|
1.0
|
CLL
|
A:27E602
|
3.5
|
72.2
|
1.0
|
CLT
|
A:27E602
|
3.5
|
82.5
|
1.0
|
CG2
|
A:THR347
|
3.6
|
45.3
|
1.0
|
CD1
|
A:LEU525
|
3.7
|
54.1
|
1.0
|
CAJ
|
A:27E602
|
4.0
|
72.0
|
1.0
|
CAF
|
A:27E602
|
4.1
|
71.1
|
1.0
|
CAD
|
A:27E602
|
4.1
|
74.8
|
1.0
|
CE
|
A:MET528
|
4.4
|
55.3
|
1.0
|
CAA
|
A:27E602
|
4.6
|
71.4
|
1.0
|
CA
|
A:THR347
|
4.6
|
33.1
|
1.0
|
CB
|
A:THR347
|
4.6
|
44.7
|
1.0
|
CD2
|
A:LEU525
|
4.6
|
43.7
|
1.0
|
CG
|
A:LEU525
|
4.6
|
48.7
|
1.0
|
CD1
|
A:LEU540
|
4.6
|
51.2
|
1.0
|
CB
|
A:ALA350
|
4.7
|
31.7
|
1.0
|
CAE
|
A:27E602
|
4.8
|
76.8
|
1.0
|
CB
|
A:LEU525
|
5.0
|
37.1
|
1.0
|
|
Chlorine binding site 4 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 4 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:74.8
occ:1.00
|
CLO
|
A:27E602
|
0.0
|
74.8
|
1.0
|
CAG
|
A:27E602
|
1.8
|
72.3
|
1.0
|
SD
|
A:MET343
|
2.8
|
62.6
|
0.1
|
CAB
|
A:27E602
|
2.9
|
75.7
|
1.0
|
CAF
|
A:27E602
|
2.9
|
71.1
|
1.0
|
CAH
|
A:27E602
|
2.9
|
76.4
|
1.0
|
CLP
|
A:27E602
|
3.3
|
69.7
|
1.0
|
CLT
|
A:27E602
|
3.4
|
82.5
|
1.0
|
CLN
|
A:27E602
|
3.4
|
82.3
|
1.0
|
CE
|
A:MET343
|
3.5
|
51.8
|
1.0
|
CAA
|
A:27E602
|
3.6
|
71.4
|
1.0
|
CB
|
A:LEU346
|
3.7
|
39.2
|
1.0
|
CAI
|
A:27E602
|
3.8
|
75.1
|
1.0
|
CLM
|
A:27E602
|
3.8
|
68.2
|
1.0
|
CAC
|
A:27E602
|
3.8
|
75.1
|
1.0
|
CAE
|
A:27E602
|
4.0
|
76.8
|
1.0
|
CG2
|
A:THR347
|
4.0
|
45.3
|
1.0
|
CAJ
|
A:27E602
|
4.0
|
72.0
|
1.0
|
CE
|
A:MET421
|
4.1
|
67.5
|
1.0
|
CD1
|
A:LEU346
|
4.2
|
39.1
|
1.0
|
CE
|
A:MET528
|
4.3
|
55.3
|
1.0
|
OAU
|
A:27E602
|
4.5
|
68.9
|
1.0
|
CAD
|
A:27E602
|
4.5
|
74.8
|
1.0
|
CG
|
A:MET343
|
4.5
|
62.3
|
1.0
|
N
|
A:THR347
|
4.5
|
35.1
|
1.0
|
CG
|
A:LEU346
|
4.6
|
40.9
|
1.0
|
C
|
A:LEU346
|
4.7
|
33.0
|
1.0
|
O
|
A:MET343
|
4.7
|
53.0
|
1.0
|
SD
|
A:MET528
|
4.7
|
78.8
|
1.0
|
CA
|
A:LEU346
|
4.8
|
38.9
|
1.0
|
SD
|
A:MET421
|
4.9
|
86.2
|
1.0
|
|
Chlorine binding site 5 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 5 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:69.7
occ:1.00
|
CLP
|
A:27E602
|
0.0
|
69.7
|
1.0
|
CAF
|
A:27E602
|
1.8
|
71.1
|
1.0
|
CAE
|
A:27E602
|
2.9
|
76.8
|
1.0
|
CAG
|
A:27E602
|
2.9
|
72.3
|
1.0
|
CAJ
|
A:27E602
|
2.9
|
72.0
|
1.0
|
CD1
|
A:LEU346
|
3.2
|
39.1
|
1.0
|
CE1
|
A:PHE404
|
3.2
|
30.7
|
1.0
|
CLO
|
A:27E602
|
3.3
|
74.8
|
1.0
|
CLQ
|
A:27E602
|
3.3
|
80.1
|
1.0
|
CLK
|
A:27E602
|
3.4
|
82.3
|
1.0
|
CAA
|
A:27E602
|
3.6
|
71.4
|
1.0
|
CAI
|
A:27E602
|
3.8
|
75.1
|
1.0
|
CAD
|
A:27E602
|
3.8
|
74.8
|
1.0
|
CLM
|
A:27E602
|
3.9
|
68.2
|
1.0
|
CZ
|
A:PHE404
|
3.9
|
38.0
|
1.0
|
CAB
|
A:27E602
|
3.9
|
75.7
|
1.0
|
CAH
|
A:27E602
|
4.0
|
76.4
|
1.0
|
CB
|
A:LEU346
|
4.1
|
39.2
|
1.0
|
CG
|
A:LEU346
|
4.1
|
40.9
|
1.0
|
CD1
|
A:PHE404
|
4.1
|
43.6
|
1.0
|
SD
|
A:MET421
|
4.2
|
86.2
|
1.0
|
OAU
|
A:27E602
|
4.4
|
68.9
|
1.0
|
CAC
|
A:27E602
|
4.5
|
75.1
|
1.0
|
CE2
|
A:PHE425
|
4.5
|
55.7
|
1.0
|
CD2
|
A:LEU346
|
4.5
|
46.4
|
1.0
|
CE
|
A:MET421
|
4.7
|
67.5
|
1.0
|
|
Chlorine binding site 6 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 6 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:80.1
occ:1.00
|
CLQ
|
A:27E602
|
0.0
|
80.1
|
1.0
|
CAE
|
A:27E602
|
1.8
|
76.8
|
1.0
|
CAA
|
A:27E602
|
2.7
|
71.4
|
1.0
|
CAF
|
A:27E602
|
2.9
|
71.1
|
1.0
|
CAD
|
A:27E602
|
2.9
|
74.8
|
1.0
|
OAU
|
A:27E602
|
3.0
|
68.9
|
1.0
|
CAJ
|
A:27E602
|
3.3
|
72.0
|
1.0
|
CLP
|
A:27E602
|
3.3
|
69.7
|
1.0
|
CLR
|
A:27E602
|
3.4
|
60.5
|
1.0
|
CLK
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CD1
|
A:LEU428
|
3.6
|
28.6
|
1.0
|
CG2
|
A:ILE424
|
3.6
|
38.3
|
1.0
|
SD
|
A:MET421
|
3.7
|
86.2
|
1.0
|
CAB
|
A:27E602
|
3.9
|
75.7
|
1.0
|
CAG
|
A:27E602
|
4.1
|
72.3
|
1.0
|
CAC
|
A:27E602
|
4.1
|
75.1
|
1.0
|
CE2
|
A:PHE425
|
4.4
|
55.7
|
1.0
|
CB
|
A:ILE424
|
4.4
|
41.1
|
1.0
|
CD2
|
A:PHE425
|
4.5
|
53.4
|
1.0
|
CE
|
A:MET388
|
4.6
|
32.4
|
1.0
|
CAI
|
A:27E602
|
4.7
|
75.1
|
1.0
|
CAH
|
A:27E602
|
4.8
|
76.4
|
1.0
|
CE1
|
A:PHE404
|
5.0
|
30.7
|
1.0
|
CE
|
A:MET421
|
5.0
|
67.5
|
1.0
|
CG
|
A:MET421
|
5.0
|
62.0
|
1.0
|
|
Chlorine binding site 7 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 7 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:60.5
occ:1.00
|
CLR
|
A:27E602
|
0.0
|
60.5
|
1.0
|
CAD
|
A:27E602
|
1.8
|
74.8
|
1.0
|
CAE
|
A:27E602
|
2.9
|
76.8
|
1.0
|
CAC
|
A:27E602
|
2.9
|
75.1
|
1.0
|
CAJ
|
A:27E602
|
2.9
|
72.0
|
1.0
|
CE
|
A:MET388
|
3.1
|
32.4
|
1.0
|
CLQ
|
A:27E602
|
3.4
|
80.1
|
1.0
|
CLS
|
A:27E602
|
3.4
|
66.9
|
1.0
|
CLK
|
A:27E602
|
3.4
|
82.3
|
1.0
|
CD1
|
A:LEU384
|
3.5
|
36.8
|
1.0
|
CAA
|
A:27E602
|
3.6
|
71.4
|
1.0
|
CG
|
A:MET388
|
3.6
|
27.9
|
1.0
|
SD
|
A:MET388
|
3.7
|
31.3
|
1.0
|
CAI
|
A:27E602
|
3.8
|
75.1
|
1.0
|
CLL
|
A:27E602
|
3.8
|
72.2
|
1.0
|
CAF
|
A:27E602
|
3.8
|
71.1
|
1.0
|
CAB
|
A:27E602
|
4.0
|
75.7
|
1.0
|
CAH
|
A:27E602
|
4.0
|
76.4
|
1.0
|
CG
|
A:LEU384
|
4.2
|
31.1
|
1.0
|
OAU
|
A:27E602
|
4.2
|
68.9
|
1.0
|
CD2
|
A:LEU384
|
4.4
|
32.3
|
1.0
|
CAG
|
A:27E602
|
4.5
|
72.3
|
1.0
|
CA
|
A:GLY521
|
4.5
|
27.3
|
1.0
|
O
|
A:HOH768
|
4.6
|
52.3
|
1.0
|
CG2
|
A:ILE424
|
4.7
|
38.3
|
1.0
|
|
Chlorine binding site 8 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 8 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:82.3
occ:1.00
|
CLK
|
A:27E602
|
0.0
|
82.3
|
1.0
|
CAJ
|
A:27E602
|
1.8
|
72.0
|
1.0
|
O
|
A:HOH768
|
2.7
|
52.3
|
1.0
|
CAI
|
A:27E602
|
2.9
|
75.1
|
1.0
|
CAF
|
A:27E602
|
2.9
|
71.1
|
1.0
|
CAD
|
A:27E602
|
2.9
|
74.8
|
1.0
|
CAE
|
A:27E602
|
3.3
|
76.8
|
1.0
|
CLR
|
A:27E602
|
3.4
|
60.5
|
1.0
|
CLP
|
A:27E602
|
3.4
|
69.7
|
1.0
|
CLL
|
A:27E602
|
3.5
|
72.2
|
1.0
|
CLM
|
A:27E602
|
3.5
|
68.2
|
1.0
|
CLQ
|
A:27E602
|
3.5
|
80.1
|
1.0
|
CD2
|
A:LEU391
|
3.8
|
26.0
|
1.0
|
CAH
|
A:27E602
|
4.0
|
76.4
|
1.0
|
O
|
A:HOH701
|
4.1
|
46.3
|
1.0
|
CE1
|
A:PHE404
|
4.1
|
30.7
|
1.0
|
CAG
|
A:27E602
|
4.1
|
72.3
|
1.0
|
CAC
|
A:27E602
|
4.2
|
75.1
|
1.0
|
CAA
|
A:27E602
|
4.6
|
71.4
|
1.0
|
CD1
|
A:PHE404
|
4.6
|
43.6
|
1.0
|
CAB
|
A:27E602
|
4.8
|
75.7
|
1.0
|
CG
|
A:MET388
|
4.9
|
27.9
|
1.0
|
|
Chlorine binding site 9 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 9 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:68.2
occ:1.00
|
CLM
|
A:27E602
|
0.0
|
68.2
|
1.0
|
CAI
|
A:27E602
|
1.8
|
75.1
|
1.0
|
CAJ
|
A:27E602
|
2.8
|
72.0
|
1.0
|
CAH
|
A:27E602
|
2.8
|
76.4
|
1.0
|
CLL
|
A:27E602
|
2.9
|
72.2
|
1.0
|
O
|
A:LEU346
|
3.2
|
35.0
|
1.0
|
CAF
|
A:27E602
|
3.2
|
71.1
|
1.0
|
CAG
|
A:27E602
|
3.3
|
72.3
|
1.0
|
CLN
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CLK
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CB
|
A:ALA350
|
3.5
|
31.7
|
1.0
|
C
|
A:LEU346
|
3.8
|
33.0
|
1.0
|
CLO
|
A:27E602
|
3.8
|
74.8
|
1.0
|
CLP
|
A:27E602
|
3.9
|
69.7
|
1.0
|
CB
|
A:LEU346
|
4.1
|
39.2
|
1.0
|
CAD
|
A:27E602
|
4.1
|
74.8
|
1.0
|
CAC
|
A:27E602
|
4.1
|
75.1
|
1.0
|
O
|
A:HOH701
|
4.3
|
46.3
|
1.0
|
N
|
A:THR347
|
4.4
|
35.1
|
1.0
|
CA
|
A:LEU346
|
4.4
|
38.9
|
1.0
|
CAB
|
A:27E602
|
4.6
|
75.7
|
1.0
|
CAE
|
A:27E602
|
4.6
|
76.8
|
1.0
|
CA
|
A:ALA350
|
4.6
|
34.0
|
1.0
|
CA
|
A:THR347
|
4.6
|
33.1
|
1.0
|
N
|
A:ALA350
|
4.7
|
29.0
|
1.0
|
O
|
A:HOH768
|
4.8
|
52.3
|
1.0
|
|
Chlorine binding site 10 out
of 20 in 4mg5
Go back to
Chlorine Binding Sites List in 4mg5
Chlorine binding site 10 out
of 20 in the Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Crystal Structure of Hera-Lbd (Y537S) in Complex with Chlordecone within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl602
b:72.2
occ:1.00
|
CLL
|
A:27E602
|
0.0
|
72.2
|
1.0
|
CAI
|
A:27E602
|
1.8
|
75.1
|
1.0
|
CAJ
|
A:27E602
|
2.8
|
72.0
|
1.0
|
CAH
|
A:27E602
|
2.8
|
76.4
|
1.0
|
CLM
|
A:27E602
|
2.9
|
68.2
|
1.0
|
CAD
|
A:27E602
|
3.2
|
74.8
|
1.0
|
CAC
|
A:27E602
|
3.3
|
75.1
|
1.0
|
CD1
|
A:LEU384
|
3.4
|
36.8
|
1.0
|
CLK
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CLN
|
A:27E602
|
3.5
|
82.3
|
1.0
|
CD1
|
A:LEU387
|
3.7
|
29.5
|
1.0
|
CLR
|
A:27E602
|
3.8
|
60.5
|
1.0
|
CLS
|
A:27E602
|
3.8
|
66.9
|
1.0
|
O
|
A:HOH768
|
3.9
|
52.3
|
1.0
|
CB
|
A:ALA350
|
4.0
|
31.7
|
1.0
|
CAF
|
A:27E602
|
4.1
|
71.1
|
1.0
|
CAG
|
A:27E602
|
4.1
|
72.3
|
1.0
|
CB
|
A:LEU387
|
4.5
|
31.1
|
1.0
|
CAE
|
A:27E602
|
4.6
|
76.8
|
1.0
|
CAB
|
A:27E602
|
4.6
|
75.7
|
1.0
|
O
|
A:HOH701
|
4.8
|
46.3
|
1.0
|
CZ3
|
A:TRP383
|
4.8
|
39.2
|
1.0
|
CG
|
A:LEU387
|
4.8
|
28.7
|
1.0
|
CG
|
A:LEU384
|
4.9
|
31.1
|
1.0
|
|
Reference:
V.Delfosse,
M.Grimaldi,
V.Cavailles,
P.Balaguer,
W.Bourguet.
Structural and Functional Profiling of Environmental Ligands For Estrogen Receptors. Environ.Health Perspect. 2014.
ISSN: ISSN 0091-6765
PubMed: 25260197
DOI: 10.1289/EHP.1408453
Page generated: Sat Dec 12 10:55:34 2020
|