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Ligand · MV1

MV1 · (2S)-2,4-dihydroxy-3,3-dimethyl-N-[3-(nonylamino)-3-oxopropyl]butanamide

MV1, (2S)-2,4-dihydroxy-3,3-dimethyl-N-[3-(nonylamino)-3-oxopropyl]butanamide (C18 H36 N2 O4, 344.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
MV1
Formula
C18 H36 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

MV1 in 2 structures; the first of them:

  • 3AVQ · Pantothenate kinase from Mycobacterium tuberculosis (MtPanK) in complex with N9-Pan · MV1 A313 · binds VAL99, ASP129, LEU132, LYS147, TYR153, TYR177, HIS179, TYR182 and 11 more
  • 3AVQ · Pantothenate kinase from mycobacterium tuberculosis (mtpank) in complex with N9-pan · MV1 A313 · binds VAL99, ASP129, LEU132, LYS147, TYR153, TYR177, HIS179, TYR182 and 11 more

Residues it binds most

TYR 2, PHE 2, ILE 2, LEU 2, ARG 2, ASN 2, ASP 2, HIS 2, LYS 2, MET 2 (residue and the binding sites it lines).

Found with

  • FLC · Citrate anion
  • GOL · Glycerol

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