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MolNFT v1 · #148693 · protein

Three dimensional structure of human carbonic anhydrase IX in complex with benzenesulfonamide.

6FE1: “Three dimensional structure of human carbonic anhydrase IX in complex with benzenesulfonamide.”. X-ray diffraction, 2 ligands (V14, ZN). MolNFT v1 #148693 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6FE1
Type
protein
Length
996 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q16790
Ligands
V14, ZN

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, D—protein251—Q16790
B—protein243—Q16790

Ligands and binding sites

  • V14 · 3-(cyclooctylamino)-2,5,6-trifluoro-4-[(2-hydroxyethyl)sulfonyl]benzenesulfonamide · ligand · 4 copies · chains A, B, C, D
  • ZN · Zinc ion · metal · 4 copies · chains A, B, C, D

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

Compared structures

  • 6FE1 · Three dimensional structure of human carbonic anhydrase IX in complex with… · the same entry in another collection · chain D against D, TM-score 1.00
  • Q16790 · AlphaFold monomer V2.0 prediction for carbonic anhydrase 9 (Q16790) · a predicted model of the same protein · chain B against A, TM-score 1.00

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