Chlorine in PDB 6hbz: Bdellovibrio Bacteriovorus Dgcb Full-Length
Protein crystallography data
The structure of Bdellovibrio Bacteriovorus Dgcb Full-Length, PDB code: 6hbz
was solved by
A.L.Lovering,
R.W.Meek,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
153.09 /
1.79
|
Space group
|
P 65 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
176.776,
176.776,
112.117,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
17.9 /
21.6
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Bdellovibrio Bacteriovorus Dgcb Full-Length
(pdb code 6hbz). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 5 binding sites of Chlorine where determined in the
Bdellovibrio Bacteriovorus Dgcb Full-Length, PDB code: 6hbz:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
Chlorine binding site 1 out
of 5 in 6hbz
Go back to
Chlorine Binding Sites List in 6hbz
Chlorine binding site 1 out
of 5 in the Bdellovibrio Bacteriovorus Dgcb Full-Length
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Bdellovibrio Bacteriovorus Dgcb Full-Length within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl403
b:22.4
occ:1.00
|
O
|
A:HOH728
|
3.2
|
32.9
|
1.0
|
N
|
A:TRP284
|
3.5
|
21.5
|
1.0
|
CA
|
A:PRO166
|
3.6
|
21.1
|
1.0
|
CA
|
A:GLU283
|
3.7
|
26.7
|
1.0
|
CB
|
A:PRO166
|
3.7
|
21.6
|
1.0
|
CG
|
A:PRO166
|
3.7
|
23.3
|
1.0
|
CD1
|
A:TRP284
|
3.9
|
22.8
|
1.0
|
O
|
A:THR282
|
4.0
|
25.5
|
1.0
|
N
|
A:PRO166
|
4.0
|
20.2
|
1.0
|
CG
|
A:MET169
|
4.1
|
23.7
|
1.0
|
C
|
A:GLU283
|
4.1
|
23.2
|
1.0
|
CD
|
A:PRO166
|
4.3
|
21.8
|
1.0
|
CB
|
A:GLU283
|
4.3
|
33.2
|
1.0
|
CB
|
A:TRP284
|
4.4
|
18.9
|
1.0
|
O
|
A:HOH703
|
4.5
|
42.0
|
1.0
|
CB
|
A:MET169
|
4.5
|
22.0
|
1.0
|
CA
|
A:TRP284
|
4.5
|
20.5
|
1.0
|
CG
|
A:TRP284
|
4.6
|
21.2
|
1.0
|
C
|
A:GLY165
|
4.6
|
19.4
|
1.0
|
O
|
A:GLY165
|
4.7
|
19.3
|
1.0
|
N
|
A:GLU283
|
4.7
|
24.6
|
1.0
|
C
|
A:THR282
|
4.8
|
23.2
|
1.0
|
CG
|
A:GLU283
|
4.8
|
40.4
|
1.0
|
C
|
A:PRO166
|
4.8
|
20.2
|
1.0
|
NE1
|
A:TRP284
|
4.9
|
23.6
|
1.0
|
O
|
A:PRO166
|
5.0
|
22.6
|
1.0
|
|
Chlorine binding site 2 out
of 5 in 6hbz
Go back to
Chlorine Binding Sites List in 6hbz
Chlorine binding site 2 out
of 5 in the Bdellovibrio Bacteriovorus Dgcb Full-Length
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Bdellovibrio Bacteriovorus Dgcb Full-Length within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl404
b:31.8
occ:1.00
|
CL
|
B:CL403
|
3.2
|
29.9
|
1.0
|
N
|
A:ARG76
|
3.3
|
20.7
|
1.0
|
O
|
A:HOH520
|
3.3
|
34.7
|
1.0
|
OD1
|
B:ASP56
|
3.5
|
26.8
|
1.0
|
NE
|
A:ARG76
|
3.5
|
37.5
|
1.0
|
O
|
A:HOH704
|
3.6
|
46.1
|
1.0
|
CB
|
A:ARG76
|
3.8
|
21.9
|
1.0
|
CG
|
A:ARG76
|
3.9
|
24.2
|
1.0
|
CB
|
A:SER75
|
3.9
|
22.2
|
1.0
|
CA
|
A:SER75
|
4.0
|
20.8
|
1.0
|
CG
|
B:ASP56
|
4.0
|
28.2
|
1.0
|
CG2
|
B:VAL58
|
4.1
|
24.4
|
1.0
|
OD2
|
B:ASP56
|
4.1
|
25.2
|
1.0
|
NH2
|
A:ARG61
|
4.1
|
36.4
|
1.0
|
C
|
A:SER75
|
4.1
|
20.5
|
1.0
|
CA
|
A:ARG76
|
4.1
|
21.1
|
1.0
|
NH2
|
A:ARG76
|
4.3
|
41.0
|
1.0
|
CD
|
A:ARG76
|
4.3
|
30.6
|
1.0
|
CZ
|
A:ARG76
|
4.4
|
40.0
|
1.0
|
OG
|
A:SER75
|
4.6
|
23.3
|
1.0
|
OE2
|
B:GLU64
|
4.8
|
47.4
|
1.0
|
CZ
|
A:ARG61
|
4.9
|
33.0
|
1.0
|
O
|
B:ASP56
|
4.9
|
34.4
|
1.0
|
N
|
A:SER77
|
5.0
|
20.7
|
1.0
|
|
Chlorine binding site 3 out
of 5 in 6hbz
Go back to
Chlorine Binding Sites List in 6hbz
Chlorine binding site 3 out
of 5 in the Bdellovibrio Bacteriovorus Dgcb Full-Length
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Bdellovibrio Bacteriovorus Dgcb Full-Length within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl401
b:54.3
occ:1.00
|
O
|
B:HOH633
|
3.0
|
54.8
|
1.0
|
O
|
B:HOH630
|
3.3
|
34.3
|
1.0
|
N
|
B:ARG76
|
3.5
|
29.5
|
1.0
|
NH1
|
B:ARG61
|
3.7
|
39.2
|
1.0
|
CA
|
B:SER75
|
3.8
|
26.1
|
1.0
|
CB
|
B:SER75
|
3.9
|
25.6
|
1.0
|
CG
|
B:ARG76
|
3.9
|
42.9
|
1.0
|
C
|
B:SER75
|
4.2
|
26.0
|
1.0
|
OG
|
B:SER75
|
4.2
|
30.2
|
1.0
|
CB
|
B:ARG76
|
4.2
|
36.1
|
1.0
|
CA
|
B:ARG76
|
4.5
|
31.1
|
1.0
|
NH2
|
B:ARG61
|
4.6
|
45.4
|
1.0
|
CZ
|
B:ARG61
|
4.6
|
40.3
|
1.0
|
CD
|
B:ARG76
|
4.6
|
50.1
|
1.0
|
|
Chlorine binding site 4 out
of 5 in 6hbz
Go back to
Chlorine Binding Sites List in 6hbz
Chlorine binding site 4 out
of 5 in the Bdellovibrio Bacteriovorus Dgcb Full-Length
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Bdellovibrio Bacteriovorus Dgcb Full-Length within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl402
b:58.1
occ:1.00
|
NE
|
B:ARG303
|
3.4
|
39.8
|
1.0
|
N
|
B:HIS188
|
3.5
|
37.2
|
1.0
|
O
|
B:HOH515
|
3.6
|
47.6
|
1.0
|
NH2
|
B:ARG303
|
3.8
|
48.6
|
0.6
|
CZ
|
B:ARG303
|
4.0
|
44.5
|
0.6
|
O
|
B:HOH601
|
4.2
|
54.5
|
1.0
|
CA
|
B:HIS188
|
4.2
|
38.6
|
1.0
|
CD
|
B:ARG303
|
4.4
|
36.7
|
1.0
|
CA
|
B:ASP187
|
4.4
|
31.3
|
1.0
|
C
|
B:ASP187
|
4.5
|
34.9
|
1.0
|
ND1
|
B:HIS188
|
4.5
|
46.6
|
1.0
|
O
|
B:ILE186
|
4.7
|
27.8
|
1.0
|
CG
|
B:HIS188
|
4.9
|
42.7
|
1.0
|
CE1
|
B:HIS188
|
5.0
|
50.9
|
1.0
|
|
Chlorine binding site 5 out
of 5 in 6hbz
Go back to
Chlorine Binding Sites List in 6hbz
Chlorine binding site 5 out
of 5 in the Bdellovibrio Bacteriovorus Dgcb Full-Length
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Bdellovibrio Bacteriovorus Dgcb Full-Length within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl403
b:29.9
occ:1.00
|
NZ
|
B:LYS80
|
3.2
|
21.1
|
1.0
|
N
|
A:SER77
|
3.2
|
20.7
|
1.0
|
CL
|
A:CL404
|
3.2
|
31.8
|
1.0
|
CE
|
B:LYS80
|
3.5
|
21.7
|
1.0
|
CD
|
B:LYS80
|
3.6
|
22.1
|
1.0
|
CB
|
A:ARG76
|
3.7
|
21.9
|
1.0
|
O
|
A:HOH619
|
3.7
|
31.4
|
1.0
|
N
|
A:ARG76
|
3.7
|
20.7
|
1.0
|
CG2
|
B:VAL58
|
3.8
|
24.4
|
1.0
|
O
|
A:SER77
|
3.8
|
20.7
|
1.0
|
OD1
|
B:ASP56
|
3.9
|
26.8
|
1.0
|
CA
|
A:ARG76
|
4.0
|
21.1
|
1.0
|
CA
|
A:SER77
|
4.0
|
20.5
|
1.0
|
C
|
A:ARG76
|
4.0
|
20.9
|
1.0
|
CB
|
A:SER77
|
4.0
|
22.3
|
1.0
|
C
|
A:SER77
|
4.3
|
19.0
|
1.0
|
CB
|
A:SER75
|
4.4
|
22.2
|
1.0
|
CD1
|
B:LEU93
|
4.5
|
28.5
|
1.0
|
OG
|
A:SER77
|
4.6
|
22.4
|
1.0
|
C
|
A:SER75
|
4.6
|
20.5
|
1.0
|
NE
|
A:ARG76
|
4.7
|
37.5
|
1.0
|
CG
|
A:ARG76
|
4.8
|
24.2
|
1.0
|
CG
|
B:LYS80
|
4.9
|
22.8
|
1.0
|
CB
|
B:LYS80
|
4.9
|
23.2
|
1.0
|
CA
|
A:SER75
|
5.0
|
20.8
|
1.0
|
|
Reference:
R.W.Meek,
I.T.Cadby,
P.J.Moynihan,
A.L.Lovering.
Structural Basis For Activation of A Diguanylate Cyclase Required For Bacterial Predation in Bdellovibrio. Nat Commun V. 10 4086 2019.
ISSN: ESSN 2041-1723
PubMed: 31501441
DOI: 10.1038/S41467-019-12051-6
Page generated: Sun Jul 28 00:44:58 2024
|