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MolNFT v1 · #161315 · protein

Structure of the tripartite motif of KAP1/TRIM28

6QAJ · ENDOLYSIN,TRANSCRIPTION intermediary factor 1-beta: “Structure of the tripartite motif of KAP1/TRIM28”. X-ray diffraction, 1 ligand (ZN), 14 pockets (best druggability 0.75). MolNFT v1 #161315 on GenesisL1: 3D structure, binding…

PDB
6QAJ
Type
protein
Length
880 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ENDOLYSIN,TRANSCRIPTION intermediary factor 1-beta
EC
3.2.1.17, 2.3.2.27
UniProt
P00720, Q13263
Ligands
ZN
Pockets
14 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 55% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AENDOLYSIN,TRANSCRIPTION intermediary factor 1-beta (EC 3.2.1.17, 2.3.2.27)protein43955% helix, 9% strandP00720, Q13263
BENDOLYSIN,TRANSCRIPTION intermediary factor 1-beta (EC 3.2.1.17, 2.3.2.27)protein44155% helix, 8% strandP00720, Q13263

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

14 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18680.750.7979empty
26650.730.7957empty
3580.660.9419empty
44490.600.7644empty
5560.590.9116empty

Interfaces

1 interface between chains.

  • A–B · 7053 Ų buried · 41 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6QAJ · Structure of the tripartite motif of KAP1/TRIM28 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13263 · AlphaFold monomer V2.0 prediction for transcription intermediary factor 1-beta (Q13263) · a predicted model of the same protein · chain A against A, TM-score 0.51

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