Zinc in PDB 6h0g: Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
Protein crystallography data
The structure of Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4), PDB code: 6h0g
was solved by
R.D.Bunker,
G.Petzold,
N.H.Thoma,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
48.60 /
4.25
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
112.510,
99.530,
166.940,
90.00,
108.49,
90.00
|
R / Rfree (%)
|
22.1 /
25.6
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
(pdb code 6h0g). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the
Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4), PDB code: 6h0g:
Jump to Zinc binding site number:
1;
2;
3;
4;
Zinc binding site 1 out
of 4 in 6h0g
Go back to
Zinc Binding Sites List in 6h0g
Zinc binding site 1 out
of 4 in the Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn501
b:75.0
occ:1.00
|
SG
|
B:CYS326
|
2.3
|
0.2
|
1.0
|
SG
|
B:CYS391
|
2.5
|
0.4
|
1.0
|
SG
|
B:CYS323
|
2.6
|
1.0
|
1.0
|
SG
|
B:CYS394
|
2.7
|
0.5
|
1.0
|
HB2
|
B:CYS326
|
2.8
|
0.7
|
0.0
|
HB3
|
B:CYS323
|
3.1
|
0.2
|
0.0
|
HB2
|
B:CYS323
|
3.1
|
0.1
|
0.0
|
CB
|
B:CYS323
|
3.1
|
0.2
|
1.0
|
HB2
|
B:CYS391
|
3.2
|
0.9
|
0.0
|
CB
|
B:CYS326
|
3.2
|
0.6
|
1.0
|
HB3
|
B:CYS391
|
3.2
|
1.0
|
0.0
|
CB
|
B:CYS391
|
3.2
|
0.2
|
1.0
|
H
|
B:CYS326
|
3.2
|
0.7
|
0.0
|
H
|
B:CYS394
|
3.3
|
0.1
|
0.0
|
HG1
|
B:THR329
|
3.4
|
0.7
|
0.0
|
HB
|
B:THR329
|
3.5
|
0.3
|
0.0
|
HB3
|
B:CYS394
|
3.8
|
0.0
|
0.0
|
HB
|
B:ILE393
|
3.8
|
0.1
|
0.0
|
HB3
|
B:GLN325
|
3.9
|
0.2
|
0.0
|
N
|
B:CYS326
|
3.9
|
0.3
|
1.0
|
CB
|
B:CYS394
|
3.9
|
0.7
|
1.0
|
HB3
|
B:CYS326
|
4.0
|
0.6
|
0.0
|
HD11
|
B:ILE398
|
4.1
|
0.8
|
0.0
|
CA
|
B:CYS326
|
4.1
|
0.3
|
1.0
|
OG1
|
B:THR329
|
4.1
|
0.2
|
1.0
|
HB2
|
B:SER396
|
4.1
|
0.0
|
0.0
|
HG21
|
B:THR329
|
4.2
|
0.0
|
0.0
|
N
|
B:CYS394
|
4.3
|
0.7
|
1.0
|
CB
|
B:THR329
|
4.3
|
0.2
|
1.0
|
H
|
B:ILE393
|
4.5
|
0.0
|
0.0
|
H
|
B:SER396
|
4.5
|
0.1
|
0.0
|
HA
|
B:CYS326
|
4.6
|
0.6
|
0.0
|
CA
|
B:CYS323
|
4.6
|
0.2
|
1.0
|
CA
|
B:CYS394
|
4.7
|
0.4
|
1.0
|
CA
|
B:CYS391
|
4.7
|
0.5
|
1.0
|
H
|
B:GLN325
|
4.7
|
0.9
|
0.0
|
CG2
|
B:THR329
|
4.7
|
0.7
|
1.0
|
HB2
|
B:CYS394
|
4.8
|
0.0
|
0.0
|
HD11
|
B:ILE331
|
4.8
|
0.5
|
0.0
|
CB
|
B:ILE393
|
4.9
|
0.9
|
1.0
|
CB
|
B:GLN325
|
4.9
|
0.6
|
1.0
|
HD13
|
B:ILE393
|
4.9
|
0.9
|
0.0
|
C
|
B:GLN325
|
5.0
|
0.4
|
1.0
|
HG22
|
B:ILE393
|
5.0
|
0.2
|
0.0
|
|
Zinc binding site 2 out
of 4 in 6h0g
Go back to
Zinc Binding Sites List in 6h0g
Zinc binding site 2 out
of 4 in the Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn501
b:75.0
occ:1.00
|
NE2
|
C:HIS435
|
2.0
|
90.1
|
1.0
|
SG
|
C:CYS419
|
2.2
|
78.4
|
1.0
|
SG
|
C:CYS422
|
2.5
|
82.4
|
1.0
|
HD2
|
C:HIS435
|
2.5
|
83.9
|
0.0
|
CD2
|
C:HIS435
|
2.5
|
85.4
|
1.0
|
NE2
|
C:HIS439
|
2.6
|
0.8
|
1.0
|
HD2
|
C:HIS439
|
2.7
|
94.7
|
0.0
|
HB3
|
C:CYS419
|
2.8
|
76.9
|
0.0
|
CD2
|
C:HIS439
|
3.0
|
99.8
|
1.0
|
CB
|
C:CYS419
|
3.0
|
76.4
|
1.0
|
HB
|
C:ILE421
|
3.0
|
83.9
|
0.0
|
HB3
|
C:PHE424
|
3.0
|
79.9
|
0.0
|
HB2
|
C:CYS419
|
3.2
|
76.5
|
0.0
|
H
|
C:CYS422
|
3.2
|
80.1
|
0.0
|
CE1
|
C:HIS435
|
3.2
|
92.9
|
1.0
|
HE1
|
C:HIS435
|
3.8
|
98.5
|
0.0
|
CG
|
C:HIS435
|
3.8
|
85.4
|
1.0
|
HD12
|
C:ILE421
|
3.8
|
86.8
|
0.0
|
H
|
C:PHE424
|
3.8
|
80.4
|
0.0
|
CE1
|
C:HIS439
|
3.9
|
0.1
|
1.0
|
H
|
C:ILE421
|
3.9
|
80.8
|
0.0
|
N
|
C:CYS422
|
3.9
|
82.0
|
1.0
|
CB
|
C:CYS422
|
4.0
|
85.1
|
1.0
|
HD2
|
C:PHE424
|
4.0
|
79.1
|
0.0
|
CB
|
C:PHE424
|
4.0
|
82.5
|
1.0
|
HA
|
C:GLN436
|
4.1
|
88.7
|
0.0
|
CB
|
C:ILE421
|
4.1
|
86.5
|
1.0
|
HG2
|
C:GLN436
|
4.1
|
88.1
|
0.0
|
ND1
|
C:HIS435
|
4.1
|
90.2
|
1.0
|
HB2
|
C:PHE424
|
4.1
|
84.8
|
0.0
|
HB3
|
C:CYS422
|
4.3
|
86.9
|
0.0
|
HG3
|
C:GLN436
|
4.3
|
83.0
|
0.0
|
CG
|
C:HIS439
|
4.3
|
0.5
|
1.0
|
HE1
|
C:HIS439
|
4.4
|
0.5
|
0.0
|
CA
|
C:CYS419
|
4.4
|
76.0
|
1.0
|
HG22
|
C:ILE421
|
4.5
|
89.3
|
0.0
|
CA
|
C:CYS422
|
4.5
|
83.7
|
1.0
|
HB2
|
B:HIS397
|
4.6
|
0.6
|
0.0
|
CD2
|
C:PHE424
|
4.6
|
81.5
|
1.0
|
N
|
C:ILE421
|
4.6
|
82.2
|
1.0
|
CD1
|
C:ILE421
|
4.7
|
90.5
|
1.0
|
CA
|
C:ILE421
|
4.7
|
85.0
|
1.0
|
CG
|
C:GLN436
|
4.7
|
85.7
|
1.0
|
CG
|
C:PHE424
|
4.7
|
83.7
|
1.0
|
C
|
C:ILE421
|
4.7
|
84.5
|
1.0
|
H
|
C:GLY423
|
4.7
|
79.3
|
0.0
|
ND1
|
C:HIS439
|
4.7
|
0.8
|
1.0
|
N
|
C:PHE424
|
4.7
|
81.6
|
1.0
|
CG2
|
C:ILE421
|
4.8
|
90.6
|
1.0
|
HB2
|
C:CYS422
|
4.8
|
87.5
|
0.0
|
HD13
|
C:ILE421
|
4.8
|
92.9
|
0.0
|
C
|
C:CYS419
|
4.9
|
76.8
|
1.0
|
CG1
|
C:ILE421
|
4.9
|
89.5
|
1.0
|
HA
|
C:CYS419
|
4.9
|
76.5
|
0.0
|
CA
|
C:GLN436
|
5.0
|
87.5
|
1.0
|
|
Zinc binding site 3 out
of 4 in 6h0g
Go back to
Zinc Binding Sites List in 6h0g
Zinc binding site 3 out
of 4 in the Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Zn501
b:75.0
occ:1.00
|
SG
|
E:CYS391
|
2.2
|
0.9
|
1.0
|
SG
|
E:CYS326
|
2.7
|
0.9
|
1.0
|
SG
|
E:CYS394
|
2.8
|
0.4
|
1.0
|
CB
|
E:CYS391
|
2.8
|
0.2
|
1.0
|
HB2
|
E:CYS391
|
2.8
|
0.8
|
0.0
|
SG
|
E:CYS323
|
2.8
|
0.2
|
1.0
|
HB3
|
E:CYS391
|
2.8
|
0.4
|
0.0
|
HB2
|
E:CYS323
|
3.1
|
0.3
|
0.0
|
H
|
E:CYS394
|
3.2
|
0.6
|
0.0
|
HB2
|
E:CYS326
|
3.2
|
0.7
|
0.0
|
HB3
|
E:CYS323
|
3.3
|
0.6
|
0.0
|
CB
|
E:CYS323
|
3.3
|
0.2
|
1.0
|
HG1
|
E:THR329
|
3.4
|
0.5
|
0.0
|
CB
|
E:CYS326
|
3.6
|
0.1
|
1.0
|
HB
|
E:THR329
|
3.6
|
0.1
|
0.0
|
H
|
E:CYS326
|
3.6
|
0.3
|
0.0
|
HB
|
E:ILE393
|
3.7
|
0.9
|
0.0
|
HD11
|
E:ILE398
|
3.9
|
0.3
|
0.0
|
HB3
|
E:CYS394
|
3.9
|
0.1
|
0.0
|
HG21
|
E:THR329
|
4.0
|
1.0
|
0.0
|
CB
|
E:CYS394
|
4.0
|
0.8
|
1.0
|
HB2
|
E:SER396
|
4.1
|
0.8
|
0.0
|
N
|
E:CYS394
|
4.1
|
0.2
|
1.0
|
H
|
E:ILE393
|
4.1
|
0.1
|
0.0
|
HB3
|
E:GLN325
|
4.2
|
0.2
|
0.0
|
OG1
|
E:THR329
|
4.2
|
0.0
|
1.0
|
CA
|
E:CYS391
|
4.3
|
0.1
|
1.0
|
CB
|
E:THR329
|
4.3
|
0.9
|
1.0
|
HB3
|
E:CYS326
|
4.3
|
0.2
|
0.0
|
H
|
E:SER396
|
4.3
|
0.6
|
0.0
|
N
|
E:CYS326
|
4.3
|
1.0
|
1.0
|
CA
|
E:CYS326
|
4.6
|
0.6
|
1.0
|
HD11
|
E:ILE331
|
4.6
|
0.6
|
0.0
|
CG2
|
E:THR329
|
4.6
|
0.5
|
1.0
|
CA
|
E:CYS394
|
4.6
|
0.7
|
1.0
|
HA
|
E:CYS391
|
4.6
|
0.5
|
0.0
|
CB
|
E:ILE393
|
4.8
|
0.8
|
1.0
|
H
|
E:ALA395
|
4.8
|
0.6
|
0.0
|
HD13
|
E:ILE393
|
4.8
|
0.8
|
0.0
|
CA
|
E:CYS323
|
4.8
|
0.7
|
1.0
|
HD12
|
E:ILE393
|
4.9
|
0.9
|
0.0
|
HB2
|
E:CYS394
|
4.9
|
0.1
|
0.0
|
C
|
E:CYS391
|
4.9
|
0.9
|
1.0
|
HG22
|
E:THR329
|
4.9
|
0.8
|
0.0
|
H
|
E:CYS391
|
4.9
|
0.3
|
0.0
|
H
|
E:GLN325
|
5.0
|
0.1
|
0.0
|
|
Zinc binding site 4 out
of 4 in 6h0g
Go back to
Zinc Binding Sites List in 6h0g
Zinc binding site 4 out
of 4 in the Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4)
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Structure of the DDB1-Crbn-Pomalidomide Complex Bound to ZNF692(ZF4) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Zn501
b:75.0
occ:1.00
|
NE2
|
F:HIS439
|
2.0
|
0.9
|
1.0
|
SG
|
F:CYS422
|
2.3
|
0.7
|
1.0
|
SG
|
F:CYS419
|
2.7
|
0.8
|
1.0
|
NE2
|
F:HIS435
|
2.7
|
0.6
|
1.0
|
HB
|
F:ILE421
|
2.8
|
0.2
|
0.0
|
CD2
|
F:HIS439
|
2.9
|
0.9
|
1.0
|
CE1
|
F:HIS439
|
2.9
|
0.7
|
1.0
|
HB3
|
F:CYS419
|
3.0
|
0.7
|
0.0
|
HD2
|
F:HIS435
|
3.0
|
0.1
|
0.0
|
H
|
F:CYS422
|
3.0
|
0.1
|
0.0
|
HD2
|
F:HIS439
|
3.1
|
0.6
|
0.0
|
CD2
|
F:HIS435
|
3.2
|
0.3
|
1.0
|
HE1
|
F:HIS439
|
3.2
|
0.9
|
0.0
|
HB3
|
F:PHE424
|
3.2
|
0.7
|
0.0
|
CB
|
F:CYS419
|
3.3
|
0.2
|
1.0
|
HB2
|
F:CYS419
|
3.6
|
0.6
|
0.0
|
CB
|
F:CYS422
|
3.7
|
0.8
|
1.0
|
N
|
F:CYS422
|
3.7
|
0.7
|
1.0
|
HB3
|
F:CYS422
|
3.8
|
0.7
|
0.0
|
CB
|
F:ILE421
|
3.8
|
0.6
|
1.0
|
HD12
|
F:ILE421
|
3.8
|
0.1
|
0.0
|
H
|
F:ILE421
|
3.9
|
0.4
|
0.0
|
H
|
F:PHE424
|
3.9
|
1.0
|
0.0
|
CE1
|
F:HIS435
|
3.9
|
0.9
|
1.0
|
CG
|
F:HIS439
|
3.9
|
0.9
|
1.0
|
ND1
|
F:HIS439
|
3.9
|
0.8
|
1.0
|
HG22
|
F:ILE421
|
4.1
|
0.1
|
0.0
|
HB2
|
F:PHE424
|
4.1
|
0.8
|
0.0
|
CB
|
F:PHE424
|
4.1
|
0.1
|
1.0
|
CA
|
F:CYS422
|
4.2
|
0.2
|
1.0
|
HB2
|
E:HIS397
|
4.3
|
0.1
|
0.0
|
HE1
|
F:HIS435
|
4.4
|
0.6
|
0.0
|
CG
|
F:HIS435
|
4.4
|
0.1
|
1.0
|
C
|
F:ILE421
|
4.4
|
0.0
|
1.0
|
HD2
|
F:PHE424
|
4.4
|
0.1
|
0.0
|
CG2
|
F:ILE421
|
4.4
|
0.2
|
1.0
|
CA
|
F:ILE421
|
4.5
|
0.8
|
1.0
|
HB2
|
F:CYS422
|
4.5
|
0.7
|
0.0
|
N
|
F:ILE421
|
4.5
|
1.0
|
1.0
|
CD1
|
F:ILE421
|
4.6
|
0.9
|
1.0
|
HG21
|
F:ILE421
|
4.7
|
0.1
|
0.0
|
H
|
F:GLY423
|
4.7
|
0.3
|
0.0
|
HA
|
F:GLN436
|
4.7
|
0.3
|
0.0
|
CG1
|
F:ILE421
|
4.7
|
0.1
|
1.0
|
HD13
|
F:ILE421
|
4.7
|
0.7
|
0.0
|
CA
|
F:CYS419
|
4.7
|
0.2
|
1.0
|
ND1
|
F:HIS435
|
4.8
|
0.5
|
1.0
|
HG2
|
F:GLN436
|
4.8
|
0.6
|
0.0
|
HB3
|
E:HIS397
|
4.8
|
0.9
|
0.0
|
N
|
F:PHE424
|
4.8
|
0.1
|
1.0
|
HD1
|
F:HIS439
|
4.8
|
0.6
|
0.0
|
C
|
F:CYS422
|
4.9
|
0.2
|
1.0
|
CG
|
F:PHE424
|
4.9
|
0.5
|
1.0
|
CB
|
E:HIS397
|
5.0
|
0.6
|
1.0
|
N
|
F:GLY423
|
5.0
|
0.6
|
1.0
|
|
Reference:
Q.L.Sievers,
G.Petzold,
R.D.Bunker,
A.Renneville,
M.Slabicki,
B.J.Liddicoat,
W.Abdulrahman,
T.Mikkelsen,
B.L.Ebert,
N.H.Thoma.
Defining the Human C2H2 Zinc Finger Degrome Targeted By Thalidomide Analogs Through Crbn. Science V. 362 2018.
ISSN: ESSN 1095-9203
PubMed: 30385546
DOI: 10.1126/SCIENCE.AAT0572
Page generated: Mon Oct 28 22:10:42 2024
|