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MolNFT v1 · #127689 · protein

Thermolysin in complex with inhibitor JC292

5N3V: “Thermolysin in complex with inhibitor JC292”. X-ray diffraction, 3 ligands (8L5, CA, ZN). MolNFT v1 #127689 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5N3V
Type
protein
Length
316 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P00800
Ligands
8L5, CA, ZN

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
E—protein316—P00800

Ligands and binding sites

  • 8L5 · ~{N}-[(2~{S})-1-(aminomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-(phenylmethoxycarbonylaminomethyl)phosphonamidic acid;hydrogen · ligand · chains E
  • CA · Calcium ion · metal · 4 copies · chains E
  • ZN · Zinc ion · metal · chains E
  • DMS · Dimethyl sulfoxide · additive · 3 copies · chains E
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 2 copies · chains E

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

Compared structures

  • 5N3V · Thermolysin in complex with inhibitor JC292 · the same entry in another collection · chain E against E, TM-score 1.00

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