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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

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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

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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

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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

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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

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