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MolNFT v1 · #169074 · protein

ASH1L set domain in complex with as-85

6WZW: “ASH1L set domain in complex with as-85”. X-ray diffraction, 2 ligands (UG7, ZN). MolNFT v1 #169074 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6WZW
Type
protein
Length
222 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9NR48
Ligands
UG7, ZN

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein222—Q9NR48

Ligands and binding sites

  • UG7 · N-{[3-(3-carbamothioylphenyl)-1-{1-[(trifluoromethyl) sulfonyl]piperidin-4-yl}-1H-indol-6-yl]methyl}azetidine-3-carboxamide · ligand · chains A
  • ZN · Zinc ion · metal · 3 copies · chains A
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains A

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

Compared structures

  • 6WZW · Ash1L SET domain in complex with AS-85 · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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