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Ligand · 3HL

3HL · (3S)-3-hydroxybutanoic acid

3HL, (3S)-3-hydroxybutanoic acid (C4 H8 O3, 104.1 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 the ligands found with…

Component
3HL
Formula
C4 H8 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

3HL in 4 structures; the first of them:

  • 5LBG · Crystal structure of the Mycobacterium tuberculosis L,D-transpeptidase-2 (LdtMt2)… · 3HL B501 · binds MET303, TYR318, SER331, GLY332, VAL333, SER351, HIS352, GLY353 and 1 more
  • 6HDY · Crystal structure of 2-Hydroxyisobutyryl-CoA Ligase (HCL) in the postadenylation state in… · 3HL A501 · binds TYR164, MET165, GLY166, SER239, GLY240, GLY265, SER266, MET267 and 2 more
  • 5LBG · Crystal structure of the mycobacterium tuberculosis L,D- transpeptidase-2 (LDTMT2)… · 3HL B501 · binds TYR318, GLY332, VAL333, HIS352, GLY353, CYS354
  • 6HDY · Crystal structure of 2-hydroxyisobutyryl-CoA ligase (hcl) in the postadenylation state in… · 3HL A501 · binds TYR164, MET165, GLY166, SER239, GLY240, GLY265, SER266, MET267 and 2 more

Residues it binds most

GLY 4, SER 3, MET 3, TYR 4, ALA 2, CYS 2, HIS 2, PHE 2, VAL 2 (residue and the binding sites it lines).

Found with

  • 8LQ · [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] (3~{S})-3-oxidanylbutanoate
  • SO4 · Sulfate ion

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