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MolNFT v1 · #174490 · protein

Structure of the engineered metallo-diels-alderase DA7 W16S

7BWW: “Structure of the engineered metallo-diels-alderase DA7 W16S”. X-ray diffraction, 2 ligands (BEZ, ZN). MolNFT v1 #174490 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7BWW
Type
protein
Length
352 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Ligands
BEZ, ZN

Structure

x-ray diffraction · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein90——
B, D—protein88——
C—protein86——

Ligands and binding sites

  • BEZ · Benzoic acid · ligand · 2 copies · chains A, C
  • ZN · Zinc ion · metal · 4 copies · chains A, B, C, D
  • ACY · Acetic acid · additive · 3 copies · chains A, B, C, D
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A, B, C, D
  • 1PE · Pentaethylene glycol · additive · chains A, D

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

Compared structures

  • 7BWW · Structure of the engineered metallo-Diels-Alderase DA7 W16S · the same entry in another collection · chain A against A, TM-score 1.00

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