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MolNFT v1 · #185387 · protein

Actinobacterial 2-hydroxyacyl-CoA lyase (achacl) structure in complex with substrate 2-hib-CoA and inactive cofactor 3-deaza-thdp

7PT1: “Actinobacterial 2-hydroxyacyl-CoA lyase (achacl) structure in complex with substrate 2-hib-CoA and inactive…”. X-ray diffraction, 3 ligands (TPW, 3KK, MG). MolNFT v1 #185387 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7PT1
Type
protein
Length
1,146 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Ligands
TPW, 3KK, MG

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein574——
B—protein572——

Ligands and binding sites

  • TPW · 2-{4-[(4-amino-2-methylpyrimidin-5-yl)methyl]-3-methylthiophen-2-yl}ethyl trihydrogen diphosphate · ligand · 2 copies · chains A, B
  • 3KK · S-{(3R,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3, 5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2, 4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} 2-hydroxy-2-methylpropanethioate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 3 copies · chains A, B

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

Compared structures

  • 7PT1 · Actinobacterial 2-hydroxyacyl-CoA lyase (AcHACL) structure in complex with substrate… · the same entry in another collection · chain A against A, TM-score 1.00

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