Chlorine in PDB 3gl1: Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
Protein crystallography data
The structure of Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae, PDB code: 3gl1
was solved by
J.Osipiuk,
H.Li,
M.Bargassa,
C.Sahi,
E.A.Craig,
A.Joachimiak,
Midwestcenter For Structural Genomics (Mcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
37.70 /
1.92
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
76.543,
54.504,
90.623,
90.00,
104.36,
90.00
|
R / Rfree (%)
|
16.4 /
21.8
|
Other elements in 3gl1:
The structure of Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
(pdb code 3gl1). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 7 binding sites of Chlorine where determined in the
Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae, PDB code: 3gl1:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
Chlorine binding site 1 out
of 7 in 3gl1
Go back to
Chlorine Binding Sites List in 3gl1
Chlorine binding site 1 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl707
b:25.8
occ:1.00
|
OG1
|
A:THR17
|
2.9
|
17.7
|
0.4
|
N
|
A:THR17
|
3.2
|
14.3
|
1.0
|
O
|
A:HOH602
|
3.2
|
13.7
|
1.0
|
O
|
A:HOH546
|
3.3
|
23.6
|
1.0
|
N
|
A:TYR18
|
3.4
|
13.8
|
1.0
|
N
|
A:THR16
|
3.6
|
13.9
|
1.0
|
O
|
A:TYR18
|
3.8
|
15.9
|
1.0
|
CB
|
A:THR17
|
3.9
|
14.3
|
0.6
|
CA
|
A:THR17
|
3.9
|
14.4
|
0.6
|
CA
|
A:THR17
|
3.9
|
14.8
|
0.4
|
O
|
A:HOH604
|
3.9
|
29.5
|
1.0
|
CB
|
A:THR17
|
3.9
|
14.8
|
0.4
|
CL
|
A:CL710
|
4.1
|
36.1
|
1.0
|
C
|
A:THR17
|
4.1
|
14.3
|
1.0
|
C
|
A:GLY15
|
4.1
|
13.6
|
1.0
|
CA
|
A:GLY15
|
4.1
|
13.7
|
1.0
|
C
|
A:THR16
|
4.2
|
14.7
|
1.0
|
CA
|
A:THR16
|
4.3
|
14.5
|
1.0
|
OG1
|
A:THR17
|
4.3
|
14.0
|
0.6
|
CA
|
A:TYR18
|
4.3
|
14.1
|
1.0
|
O
|
A:HOH632
|
4.3
|
15.9
|
1.0
|
O
|
A:HOH548
|
4.4
|
12.9
|
1.0
|
CB
|
A:THR16
|
4.4
|
15.6
|
1.0
|
CB
|
A:TYR18
|
4.5
|
13.5
|
1.0
|
CG2
|
A:THR17
|
4.5
|
14.9
|
0.4
|
C
|
A:TYR18
|
4.5
|
14.1
|
1.0
|
CD2
|
A:TYR18
|
4.9
|
19.1
|
1.0
|
O
|
A:HOH440
|
4.9
|
14.7
|
1.0
|
MG
|
A:MG701
|
4.9
|
20.4
|
1.0
|
O
|
A:GLY15
|
5.0
|
14.0
|
1.0
|
OG1
|
A:THR16
|
5.0
|
12.1
|
1.0
|
|
Chlorine binding site 2 out
of 7 in 3gl1
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Chlorine Binding Sites List in 3gl1
Chlorine binding site 2 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl708
b:19.8
occ:1.00
|
O
|
B:HOH439
|
3.1
|
14.2
|
1.0
|
N
|
A:ASP288
|
3.2
|
14.1
|
1.0
|
O
|
A:HOH393
|
3.2
|
11.4
|
1.0
|
O
|
B:HOH659
|
3.2
|
19.7
|
1.0
|
NH2
|
A:ARG265
|
3.5
|
9.0
|
1.0
|
CB
|
A:ASP288
|
3.8
|
15.2
|
1.0
|
CA
|
A:VAL287
|
3.9
|
14.5
|
1.0
|
C
|
A:VAL287
|
4.0
|
15.4
|
1.0
|
CA
|
A:ASP288
|
4.1
|
14.9
|
1.0
|
O
|
B:HOH398
|
4.3
|
23.6
|
1.0
|
CG1
|
A:VAL287
|
4.4
|
12.9
|
1.0
|
O
|
A:GLU286
|
4.4
|
15.6
|
1.0
|
CD
|
B:ARG345
|
4.4
|
18.2
|
1.0
|
O
|
A:HOH519
|
4.5
|
22.5
|
1.0
|
O
|
A:ASP288
|
4.6
|
14.3
|
1.0
|
O
|
B:SER278
|
4.6
|
16.3
|
1.0
|
O
|
B:HOH474
|
4.7
|
8.7
|
1.0
|
CB
|
A:VAL287
|
4.7
|
14.1
|
1.0
|
CZ
|
A:ARG265
|
4.7
|
12.7
|
1.0
|
N
|
A:VAL287
|
4.8
|
15.9
|
1.0
|
CB
|
B:SER278
|
4.9
|
14.4
|
1.0
|
O
|
B:HOH545
|
4.9
|
18.6
|
1.0
|
C
|
A:ASP288
|
4.9
|
14.6
|
1.0
|
C
|
A:GLU286
|
4.9
|
15.7
|
1.0
|
CB
|
B:ARG345
|
4.9
|
15.2
|
1.0
|
CG
|
B:ARG345
|
5.0
|
16.4
|
1.0
|
NE
|
B:ARG345
|
5.0
|
15.7
|
1.0
|
|
Chlorine binding site 3 out
of 7 in 3gl1
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Chlorine Binding Sites List in 3gl1
Chlorine binding site 3 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl710
b:36.1
occ:1.00
|
O
|
A:HOH548
|
2.9
|
12.9
|
1.0
|
OG1
|
A:THR16
|
3.0
|
12.1
|
1.0
|
NZ
|
A:LYS73
|
3.0
|
20.4
|
1.0
|
N
|
A:THR16
|
3.4
|
13.9
|
1.0
|
O
|
A:HOH440
|
3.6
|
14.7
|
1.0
|
CB
|
A:THR16
|
3.8
|
15.6
|
1.0
|
CE
|
A:LYS73
|
4.0
|
19.4
|
1.0
|
O
|
A:HOH675
|
4.0
|
36.8
|
1.0
|
CA
|
A:GLY15
|
4.1
|
13.7
|
1.0
|
CL
|
A:CL707
|
4.1
|
25.8
|
1.0
|
CA
|
A:THR16
|
4.2
|
14.5
|
1.0
|
OG1
|
A:THR207
|
4.2
|
22.6
|
1.0
|
C
|
A:GLY15
|
4.2
|
13.6
|
1.0
|
CD
|
A:LYS73
|
4.3
|
16.4
|
1.0
|
OE1
|
A:GLU177
|
4.3
|
18.6
|
1.0
|
CG2
|
A:THR207
|
4.3
|
24.7
|
1.0
|
MG
|
A:MG701
|
4.4
|
20.4
|
1.0
|
O
|
A:HOH602
|
4.5
|
13.7
|
1.0
|
OE2
|
A:GLU177
|
4.5
|
20.4
|
1.0
|
O
|
A:HOH546
|
4.7
|
23.6
|
1.0
|
CB
|
A:THR207
|
4.8
|
22.9
|
1.0
|
CD
|
A:GLU177
|
4.8
|
19.5
|
1.0
|
|
Chlorine binding site 4 out
of 7 in 3gl1
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Chlorine Binding Sites List in 3gl1
Chlorine binding site 4 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl711
b:33.1
occ:1.00
|
NH2
|
B:ARG345
|
3.2
|
15.6
|
1.0
|
ND2
|
B:ASN367
|
3.3
|
16.3
|
1.0
|
NE
|
A:ARG261
|
3.3
|
26.6
|
0.6
|
CZ
|
A:ARG261
|
3.5
|
25.9
|
0.6
|
CD
|
A:ARG265
|
3.6
|
12.4
|
1.0
|
CD
|
A:ARG261
|
3.7
|
24.1
|
0.4
|
NE
|
A:ARG265
|
3.7
|
13.6
|
1.0
|
NH1
|
B:ARG345
|
3.7
|
16.3
|
1.0
|
NH2
|
A:ARG261
|
3.7
|
25.3
|
0.6
|
CZ
|
A:ARG265
|
3.8
|
12.7
|
1.0
|
NH1
|
A:ARG265
|
3.8
|
15.1
|
1.0
|
CD
|
A:ARG261
|
3.9
|
24.8
|
0.6
|
CZ
|
B:ARG345
|
3.9
|
16.3
|
1.0
|
NH1
|
A:ARG261
|
4.1
|
25.9
|
0.6
|
CB
|
B:ASN367
|
4.1
|
14.3
|
1.0
|
CG
|
B:ASN367
|
4.2
|
15.3
|
1.0
|
NE
|
A:ARG261
|
4.5
|
25.2
|
0.4
|
CG
|
A:ARG261
|
4.5
|
22.5
|
0.4
|
O
|
A:HOH469
|
4.5
|
18.6
|
1.0
|
CG
|
A:ARG261
|
4.5
|
22.9
|
0.6
|
NH2
|
A:ARG265
|
4.5
|
9.0
|
1.0
|
O
|
A:HOH606
|
4.6
|
15.6
|
1.0
|
NH1
|
A:ARG261
|
4.7
|
25.4
|
0.4
|
O
|
B:HOH471
|
4.8
|
15.8
|
1.0
|
CG
|
A:ARG265
|
4.8
|
13.6
|
1.0
|
CA
|
B:ASN367
|
4.8
|
13.9
|
1.0
|
CZ
|
A:ARG261
|
4.9
|
25.1
|
0.4
|
|
Chlorine binding site 5 out
of 7 in 3gl1
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Chlorine Binding Sites List in 3gl1
Chlorine binding site 5 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl704
b:20.6
occ:1.00
|
OG1
|
B:THR16
|
2.9
|
10.3
|
1.0
|
O
|
B:HOH540
|
3.1
|
14.0
|
1.0
|
NZ
|
B:LYS73
|
3.1
|
12.8
|
1.0
|
N
|
B:THR16
|
3.3
|
12.5
|
1.0
|
OG1
|
B:THR207
|
3.5
|
17.1
|
1.0
|
O
|
B:HOH642
|
3.6
|
16.9
|
1.0
|
CB
|
B:THR16
|
3.6
|
11.8
|
1.0
|
O
|
B:HOH438
|
3.7
|
14.2
|
1.0
|
O
|
B:HOH426
|
3.8
|
9.4
|
1.0
|
CE
|
B:LYS73
|
3.9
|
15.5
|
1.0
|
CA
|
B:THR16
|
4.0
|
11.8
|
1.0
|
CD
|
B:LYS73
|
4.1
|
14.3
|
1.0
|
CA
|
B:GLY15
|
4.1
|
12.3
|
1.0
|
C
|
B:GLY15
|
4.2
|
12.3
|
1.0
|
CG2
|
B:THR207
|
4.3
|
12.4
|
1.0
|
C3
|
B:GOL712
|
4.3
|
18.4
|
1.0
|
OE1
|
B:GLU177
|
4.3
|
16.8
|
1.0
|
CL
|
B:CL705
|
4.4
|
20.6
|
1.0
|
MG
|
B:MG702
|
4.5
|
15.8
|
1.0
|
CB
|
B:THR207
|
4.5
|
16.6
|
1.0
|
O
|
B:HOH478
|
4.5
|
17.5
|
1.0
|
O
|
B:HOH655
|
4.6
|
14.6
|
1.0
|
OE2
|
B:GLU177
|
4.7
|
15.9
|
1.0
|
CD
|
B:GLU177
|
4.9
|
14.4
|
1.0
|
O3
|
B:GOL712
|
4.9
|
22.6
|
1.0
|
CG
|
B:PRO149
|
5.0
|
15.3
|
1.0
|
|
Chlorine binding site 6 out
of 7 in 3gl1
Go back to
Chlorine Binding Sites List in 3gl1
Chlorine binding site 6 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl705
b:20.6
occ:1.00
|
O
|
B:HOH438
|
3.0
|
14.2
|
1.0
|
OG1
|
B:THR17
|
3.1
|
17.5
|
1.0
|
O
|
B:HOH616
|
3.1
|
32.9
|
1.0
|
N
|
B:THR17
|
3.1
|
12.0
|
1.0
|
O
|
B:HOH655
|
3.2
|
14.6
|
1.0
|
N
|
B:TYR18
|
3.5
|
12.8
|
1.0
|
N
|
B:THR16
|
3.6
|
12.5
|
1.0
|
CA
|
B:THR17
|
3.8
|
12.9
|
1.0
|
CB
|
B:THR17
|
3.9
|
13.7
|
1.0
|
N
|
B:GLY205
|
3.9
|
15.1
|
1.0
|
O
|
B:TYR18
|
4.1
|
15.0
|
1.0
|
C
|
B:GLY15
|
4.1
|
12.3
|
1.0
|
O
|
B:HOH540
|
4.1
|
14.0
|
1.0
|
C
|
B:THR16
|
4.1
|
12.2
|
1.0
|
C
|
B:THR17
|
4.2
|
13.8
|
1.0
|
CA
|
B:THR16
|
4.2
|
11.8
|
1.0
|
CA
|
B:GLY15
|
4.2
|
12.3
|
1.0
|
CG2
|
B:THR17
|
4.3
|
12.7
|
1.0
|
O
|
B:HOH472
|
4.3
|
19.2
|
1.0
|
CB
|
B:THR16
|
4.3
|
11.8
|
1.0
|
CL
|
B:CL704
|
4.4
|
20.6
|
1.0
|
CA
|
B:TYR18
|
4.5
|
14.6
|
1.0
|
CA
|
B:GLY205
|
4.6
|
14.8
|
1.0
|
CB
|
B:TYR18
|
4.7
|
15.2
|
1.0
|
MG
|
B:MG702
|
4.7
|
15.8
|
1.0
|
CA
|
B:GLY204
|
4.8
|
14.9
|
1.0
|
C
|
B:TYR18
|
4.8
|
15.2
|
1.0
|
C
|
B:GLY204
|
4.8
|
13.9
|
1.0
|
N
|
B:GLY206
|
4.8
|
13.6
|
1.0
|
O
|
B:HOH604
|
4.9
|
20.9
|
1.0
|
O
|
B:HOH426
|
4.9
|
9.4
|
1.0
|
O
|
B:GLY15
|
5.0
|
13.5
|
1.0
|
|
Chlorine binding site 7 out
of 7 in 3gl1
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Chlorine Binding Sites List in 3gl1
Chlorine binding site 7 out
of 7 in the Crystal Structure of Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae
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 Atpase Domain of SSB1 Chaperone, A Member of the HSP70 Family, From Saccharomyces Cerevisiae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl709
b:30.7
occ:1.00
|
O
|
B:HOH461
|
2.9
|
17.2
|
1.0
|
O
|
B:HOH396
|
3.1
|
37.6
|
1.0
|
N
|
B:ASN176
|
3.2
|
15.3
|
1.0
|
CB
|
B:ILE175
|
3.6
|
17.9
|
1.0
|
CA
|
B:ILE175
|
3.6
|
18.4
|
1.0
|
ND2
|
B:ASN176
|
3.8
|
13.2
|
1.0
|
C
|
B:ILE175
|
3.9
|
17.2
|
1.0
|
CG
|
B:ASN176
|
4.0
|
15.9
|
1.0
|
CG2
|
B:ILE175
|
4.0
|
18.9
|
1.0
|
CG2
|
B:THR179
|
4.1
|
18.5
|
1.0
|
CB
|
B:ASN176
|
4.1
|
14.7
|
1.0
|
CB
|
B:THR179
|
4.2
|
17.9
|
1.0
|
OG1
|
B:THR179
|
4.2
|
17.6
|
1.0
|
CA
|
B:ASN176
|
4.3
|
14.7
|
1.0
|
O
|
B:ILE174
|
4.6
|
20.6
|
1.0
|
OD1
|
B:ASN176
|
4.7
|
15.8
|
1.0
|
CG1
|
B:ILE175
|
4.8
|
21.0
|
1.0
|
N
|
B:ILE175
|
4.9
|
17.5
|
1.0
|
|
Reference:
J.Osipiuk,
H.Li,
M.Bargassa,
C.Sahi,
E.A.Craig,
A.Joachimiak.
Crystal Structure of Atpase Domain of SSB1 Chaperone, Member of the HSP70 Family From Saccharomyces Cerevisiae. To Be Published.
Page generated: Sat Jul 20 20:22:07 2024
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