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Ligand · 1CO

1CO · (3S)-3-hydroxy-3-methyl-5-sulfanylpentanoic acid

1CO, (3S)-3-hydroxy-3-methyl-5-sulfanylpentanoic acid (C6 H12 O3 S, 164.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and…

Component
1CO
Formula
C6 H12 O3 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

1CO in 4 structures; the first of them:

  • 4I4B · HMG-CoA Reductase from Pseudomonas mevalonii complexed with NAD and intermediate… · 1CO B1002 · binds ILE213, LEU214, ASP283, GLU583, ARG761, THR764, HIS765, LYS767 and 4 more
  • 4I6W · 3-hydroxy-3-methylglutaryl (HMG) Coenzyme-A reductase complexed with thiomevalonate · 1CO A501 · binds GLU83, ARG261, THR264, HIS265, LYS267, GLY268, ASN271, ALA368 and 3 more
  • 4I4B · Hmg-CoA reductase from pseudomonas mevalonii complexed with NAD and intermediate… · 1CO B1002 · binds ILE213, LEU214, ASP283, GLU583, ARG761, THR764, HIS765, LYS767 and 4 more
  • 4I6W · 3-hydroxy-3-methylglutaryl (hmg) coenzyme-a reductase complexed with thiomevalonate · 1CO A501 · binds GLU83, ARG261, THR264, HIS265, LYS267, GLY268, ASN271, ALA368 and 3 more

Residues it binds most

LEU 6, ALA 6, ARG 6, ASN 6, ASP 6, GLU 6, GLY 6, HIS 6, ILE 6, LYS 6 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol
  • 1CV · (3R,5R,9R,19R,21S)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9,21-tetrahydroxy-8,8,21-trimethyl-10,14-dioxo-19-sulfanyl-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphatricosan-23-oic acid 3,5-dioxide
  • NAD · Nicotinamide-adenine-dinucleotide

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