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MolNFT v1 · #165455 · protein

Human CD73 (ecto 5'-nucleotidase) in complex with PSB12690 (an aopcp derivative, compound 10 in publication) in the closed state

6TW0: “Human CD73 (ecto 5'-nucleotidase) in complex with PSB12690 (an aopcp derivative, compound 10 in publication)…”. X-ray diffraction, 2 ligands (NYZ, ZN). MolNFT v1 #165455 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6TW0
Type
protein
Length
518 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P21589
Ligands
NYZ, ZN

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein518—P21589

Ligands and binding sites

  • NYZ · [[(2~{R},3~{S},4~{R},5~{R})-5-(6-azanyl-2-oxidanylidene-3~{H}-purin-9-yl)-3,4-bis(oxidanyl) oxolan-2-yl]methoxy-oxidanyl-phosphoryl]methylphosphonic acid · ligand · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A

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

Compared structures

  • 6TW0 · Human CD73 (ecto 5'-nucleotidase) in complex with PSB12690 (an AOPCP derivative, compound… · the same entry in another collection · chain A against A, TM-score 1.00
  • P21589 · AlphaFold monomer V2.0 prediction for 5'-nucleotidase (P21589) · a predicted model of the same protein · chain A against A, TM-score 0.97

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