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MolNFT v1 · #166785 · protein

Crystal structure of the bromodomain of human BRD7 bound to TG003

6V0Q: “Crystal structure of the bromodomain of human BRD7 bound to TG003”. X-ray diffraction, 3 ligands (EAE, PO4, CL). MolNFT v1 #166785 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6V0Q
Type
protein
Length
470 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9NPI1
Ligands
EAE, PO4, CL

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein119—Q9NPI1
B, C, D—protein117—Q9NPI1

Ligands and binding sites

  • EAE · (1~{Z})-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)propan-2-one · ligand · 4 copies · chains A, B, C, D
  • PO4 · Phosphate ion · ion · chains A
  • CL · Chloride ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, D
  • GOL · Glycerol · additive · chains A

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

Compared structures

  • 6V0Q · Crystal structure of the bromodomain of human BRD7 bound to TG003 · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9NPI1 · AlphaFold monomer V2.0 prediction for bromodomain-containing protein 7 (Q9NPI1) · a predicted model of the same protein · chain B against A, TM-score 0.99

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