Caesium in PDB 4txg: Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Protein crystallography data
The structure of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum, PDB code: 4txg
was solved by
H.M.Pereira,
C.S.Teixeira,
T.B.Grangeiro,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
37.97 /
1.75
|
Space group
|
P 61
|
Cell size a, b, c (Å), α, β, γ (°)
|
126.866,
126.866,
93.815,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
15.7 /
17.6
|
Caesium Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
14;
Binding sites:
The binding sites of Caesium atom in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
(pdb code 4txg). This binding sites where shown within
5.0 Angstroms radius around Caesium atom.
In total 14 binding sites of Caesium where determined in the
Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum, PDB code: 4txg:
Jump to Caesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Caesium binding site 1 out
of 14 in 4txg
Go back to
Caesium Binding Sites List in 4txg
Caesium binding site 1 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 1 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs801
b:44.0
occ:1.00
|
O
|
A:HOH964
|
2.9
|
16.2
|
1.0
|
O
|
A:SER711
|
3.0
|
28.3
|
1.0
|
O
|
A:HOH916
|
3.2
|
21.8
|
1.0
|
O
|
A:GLY712
|
4.0
|
23.0
|
1.0
|
C
|
A:GLY712
|
4.1
|
24.5
|
1.0
|
CE1
|
A:PHE713
|
4.2
|
47.9
|
1.0
|
C
|
A:SER711
|
4.2
|
27.4
|
1.0
|
CD1
|
A:PHE713
|
4.2
|
44.5
|
1.0
|
CA
|
A:GLY712
|
4.4
|
23.7
|
1.0
|
N
|
A:PHE713
|
4.5
|
22.0
|
1.0
|
N
|
A:GLY712
|
4.8
|
24.3
|
1.0
|
CZ2
|
A:TRP744
|
4.8
|
14.2
|
1.0
|
CZ
|
A:PHE713
|
4.9
|
50.5
|
1.0
|
CG
|
A:PHE713
|
4.9
|
42.0
|
1.0
|
CG
|
A:PRO742
|
4.9
|
19.2
|
1.0
|
CA
|
A:PHE713
|
4.9
|
25.8
|
1.0
|
|
Caesium binding site 2 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 2 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 2 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs802
b:52.8
occ:1.00
|
O
|
A:TYR555
|
3.0
|
19.7
|
1.0
|
O
|
A:GLU529
|
3.1
|
18.8
|
1.0
|
OG
|
A:SER554
|
3.6
|
35.8
|
1.0
|
O
|
A:HOH1179
|
3.6
|
15.8
|
1.0
|
O
|
A:HOH1289
|
3.7
|
17.1
|
1.0
|
C
|
A:TYR555
|
3.9
|
17.2
|
1.0
|
C
|
A:GLU529
|
4.2
|
16.1
|
1.0
|
N
|
A:TYR555
|
4.4
|
13.6
|
1.0
|
CA
|
A:GLN556
|
4.6
|
12.8
|
1.0
|
N
|
A:GLN556
|
4.6
|
11.6
|
1.0
|
CA
|
A:TYR555
|
4.7
|
11.7
|
1.0
|
CA
|
A:GLU529
|
4.7
|
14.8
|
1.0
|
CB
|
A:SER554
|
4.9
|
29.1
|
1.0
|
|
Caesium binding site 3 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 3 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 3 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs803
b:55.6
occ:1.00
|
O
|
A:HOH1751
|
2.7
|
43.0
|
1.0
|
OE2
|
A:GLU314
|
3.1
|
14.8
|
1.0
|
O
|
A:HOH1398
|
3.1
|
29.1
|
1.0
|
OE1
|
A:GLU314
|
3.2
|
14.9
|
1.0
|
O
|
A:HOH1712
|
3.3
|
18.7
|
1.0
|
O
|
A:HOH1767
|
3.4
|
33.8
|
1.0
|
O
|
A:HOH1717
|
3.4
|
27.2
|
1.0
|
CD
|
A:GLU314
|
3.5
|
15.3
|
1.0
|
SD
|
A:MET395
|
3.6
|
16.3
|
1.0
|
O
|
A:HOH1173
|
3.9
|
15.7
|
1.0
|
O
|
A:HOH1713
|
4.0
|
17.2
|
1.0
|
OH
|
A:TYR315
|
4.2
|
17.5
|
1.0
|
CE
|
A:MET395
|
4.4
|
7.1
|
1.0
|
CS
|
A:CS812
|
4.4
|
0.3
|
1.0
|
O
|
A:HOH1348
|
4.5
|
25.0
|
1.0
|
CE1
|
A:TYR397
|
4.6
|
13.4
|
1.0
|
OD2
|
A:ASP398
|
4.8
|
24.3
|
1.0
|
CG
|
A:MET395
|
4.8
|
9.5
|
1.0
|
CG
|
A:GLU314
|
4.9
|
9.9
|
1.0
|
O
|
A:HOH1745
|
4.9
|
35.4
|
1.0
|
|
Caesium binding site 4 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 4 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 4 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs804
b:94.4
occ:1.00
|
OE1
|
A:GLN238
|
3.0
|
17.5
|
1.0
|
CS
|
A:CS809
|
3.2
|
0.3
|
1.0
|
O
|
A:MET223
|
3.6
|
14.2
|
1.0
|
CD
|
A:GLN238
|
3.9
|
13.1
|
1.0
|
O
|
A:GLU222
|
3.9
|
14.8
|
1.0
|
C
|
A:MET223
|
4.0
|
11.2
|
1.0
|
CA
|
A:ASP224
|
4.2
|
10.3
|
1.0
|
N
|
A:ASP224
|
4.2
|
11.4
|
1.0
|
O
|
A:HOH973
|
4.3
|
23.9
|
1.0
|
NE2
|
A:GLN238
|
4.3
|
9.7
|
1.0
|
CB
|
A:GLU222
|
4.3
|
15.5
|
1.0
|
C
|
A:GLU222
|
4.4
|
12.2
|
1.0
|
CB
|
A:ASP224
|
4.6
|
10.6
|
1.0
|
N
|
A:MET223
|
4.9
|
10.8
|
1.0
|
|
Caesium binding site 5 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 5 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 5 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs805
b:72.0
occ:1.00
|
O
|
A:HOH1094
|
3.0
|
14.5
|
1.0
|
OG
|
A:SER429
|
3.0
|
18.1
|
1.0
|
N
|
A:SER429
|
3.3
|
12.9
|
1.0
|
N
|
A:TYR428
|
3.4
|
11.7
|
1.0
|
CA
|
A:ASN426
|
3.5
|
12.1
|
1.0
|
CB
|
A:TYR428
|
3.6
|
12.4
|
1.0
|
C
|
A:ASN426
|
3.6
|
14.9
|
1.0
|
CB
|
A:SER429
|
3.7
|
13.9
|
1.0
|
O
|
A:ALA423
|
3.7
|
10.9
|
1.0
|
CA
|
A:ALA423
|
3.8
|
13.4
|
1.0
|
CA
|
A:TYR428
|
3.8
|
14.0
|
1.0
|
OD1
|
A:ASN426
|
3.9
|
18.7
|
1.0
|
N
|
A:VAL427
|
3.9
|
10.8
|
1.0
|
C
|
A:TYR428
|
4.0
|
14.7
|
1.0
|
CA
|
A:SER429
|
4.1
|
13.7
|
1.0
|
O
|
A:ASN426
|
4.1
|
13.6
|
1.0
|
C
|
A:ALA423
|
4.2
|
13.0
|
1.0
|
CD2
|
A:TYR428
|
4.3
|
10.4
|
1.0
|
N
|
A:ASN426
|
4.3
|
11.2
|
1.0
|
O
|
A:LEU422
|
4.3
|
11.5
|
1.0
|
C
|
A:VAL427
|
4.4
|
9.9
|
1.0
|
CG
|
A:TYR428
|
4.4
|
8.0
|
1.0
|
CB
|
A:ALA423
|
4.4
|
10.8
|
1.0
|
CG
|
A:ASN426
|
4.5
|
15.8
|
1.0
|
CB
|
A:ASN426
|
4.6
|
10.4
|
1.0
|
CA
|
A:VAL427
|
4.7
|
10.5
|
1.0
|
O
|
A:HOH1287
|
4.7
|
23.1
|
1.0
|
N
|
A:ALA423
|
4.8
|
10.0
|
1.0
|
O
|
A:HOH1056
|
4.8
|
33.9
|
1.0
|
C
|
A:LEU422
|
4.9
|
13.1
|
1.0
|
O
|
A:HOH1779
|
5.0
|
41.0
|
1.0
|
|
Caesium binding site 6 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 6 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 6 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs806
b:92.2
occ:1.00
|
O
|
A:PHE734
|
3.1
|
8.9
|
1.0
|
OG
|
A:SER719
|
3.2
|
30.9
|
1.0
|
O
|
A:HOH1214
|
3.2
|
19.9
|
1.0
|
O
|
A:HOH1632
|
3.6
|
35.2
|
1.0
|
O
|
A:HOH1146
|
3.7
|
15.8
|
1.0
|
O
|
A:SER719
|
3.7
|
17.9
|
1.0
|
O
|
A:HOH1567
|
3.8
|
34.8
|
1.0
|
O
|
A:HOH1616
|
3.9
|
35.3
|
1.0
|
N
|
A:GLY721
|
4.0
|
11.7
|
1.0
|
C
|
A:PHE734
|
4.1
|
8.3
|
1.0
|
CB
|
A:SER719
|
4.1
|
22.9
|
1.0
|
CA
|
A:GLY721
|
4.1
|
12.0
|
1.0
|
C
|
A:SER719
|
4.3
|
20.3
|
1.0
|
O
|
A:HOH1753
|
4.5
|
37.1
|
1.0
|
C
|
A:ALA720
|
4.5
|
17.3
|
1.0
|
N
|
A:ARG736
|
4.5
|
9.9
|
1.0
|
CB
|
A:PHE734
|
4.8
|
8.5
|
1.0
|
CA
|
A:SER719
|
4.8
|
19.1
|
1.0
|
CA
|
A:PHE734
|
4.9
|
7.3
|
1.0
|
CA
|
A:ASN735
|
4.9
|
8.9
|
1.0
|
O
|
A:ALA720
|
4.9
|
20.5
|
1.0
|
N
|
A:ASN735
|
4.9
|
7.4
|
1.0
|
N
|
A:ALA720
|
4.9
|
17.8
|
1.0
|
CB
|
A:ARG736
|
5.0
|
11.3
|
1.0
|
|
Caesium binding site 7 out
of 14 in 4txg
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Caesium Binding Sites List in 4txg
Caesium binding site 7 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 7 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs807
b:95.8
occ:1.00
|
O
|
A:HOH1769
|
2.7
|
60.2
|
1.0
|
O
|
A:HOH1853
|
3.1
|
40.0
|
1.0
|
O
|
A:HOH1743
|
3.2
|
38.6
|
1.0
|
O
|
A:HOH1725
|
3.2
|
30.1
|
1.0
|
O
|
A:HOH1722
|
3.4
|
35.1
|
1.0
|
O
|
A:HOH1788
|
3.6
|
35.1
|
1.0
|
O
|
A:HOH1749
|
4.1
|
38.0
|
1.0
|
O
|
A:HOH1718
|
4.2
|
26.1
|
1.0
|
O
|
A:HOH1767
|
4.4
|
33.8
|
1.0
|
CZ2
|
A:TRP603
|
4.5
|
11.1
|
1.0
|
NE1
|
A:TRP603
|
4.7
|
10.2
|
1.0
|
CE2
|
A:TRP603
|
4.9
|
10.0
|
1.0
|
CZ2
|
A:TRP163
|
4.9
|
14.7
|
1.0
|
OD2
|
A:ASP507
|
5.0
|
38.9
|
1.0
|
|
Caesium binding site 8 out
of 14 in 4txg
Go back to
Caesium Binding Sites List in 4txg
Caesium binding site 8 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 8 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs808
b:89.0
occ:1.00
|
O
|
A:LYS641
|
3.3
|
21.7
|
1.0
|
O
|
A:HOH1757
|
3.5
|
48.3
|
1.0
|
OG
|
A:SER643
|
3.8
|
55.9
|
1.0
|
N
|
A:SER643
|
3.8
|
31.8
|
1.0
|
CB
|
A:SER643
|
3.9
|
49.7
|
1.0
|
O
|
A:HOH1086
|
4.0
|
35.4
|
1.0
|
C
|
A:LYS641
|
4.1
|
17.1
|
1.0
|
C
|
A:VAL642
|
4.3
|
25.2
|
1.0
|
O
|
A:HOH1514
|
4.4
|
32.9
|
1.0
|
O
|
A:HOH903
|
4.4
|
38.9
|
1.0
|
CA
|
A:VAL642
|
4.4
|
16.7
|
1.0
|
CA
|
A:SER643
|
4.4
|
41.0
|
1.0
|
O
|
A:PRO640
|
4.6
|
16.3
|
1.0
|
N
|
A:VAL642
|
4.6
|
14.6
|
1.0
|
|
Caesium binding site 9 out
of 14 in 4txg
Go back to
Caesium Binding Sites List in 4txg
Caesium binding site 9 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 9 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs809
b:0.3
occ:1.00
|
CS
|
A:CS804
|
3.2
|
94.4
|
1.0
|
O
|
A:MET223
|
4.2
|
14.2
|
1.0
|
|
Caesium binding site 10 out
of 14 in 4txg
Go back to
Caesium Binding Sites List in 4txg
Caesium binding site 10 out
of 14 in the Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 10 of Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs810
b:0.3
occ:1.00
|
O
|
A:HOH1730
|
3.0
|
31.4
|
1.0
|
O
|
A:VAL727
|
3.1
|
15.7
|
1.0
|
O
|
A:HOH925
|
3.5
|
27.1
|
1.0
|
C
|
A:VAL727
|
4.2
|
15.8
|
1.0
|
CE
|
A:LYS731
|
4.9
|
35.6
|
1.0
|
CB
|
A:VAL727
|
4.9
|
20.4
|
1.0
|
CA
|
A:GLY728
|
5.0
|
16.0
|
1.0
|
CG1
|
A:VAL727
|
5.0
|
23.9
|
1.0
|
|
Reference:
H.M.Pereira,
C.S.Teixeira,
T.B.Grangeiro.
Crystal Structure of A Family GH18 Chitinase From Chromobacterium Violaceum To Be Published.
Page generated: Tue Jul 30 20:39:01 2024
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