GL1X · GenesisL1 explorer

Ligand · V7G

V7G · N-[(2S)-1-({(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide

V7G, N-[(2S)-1-({(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide (C30 H35 N5 O5 S, 577.7 g/mol), in the MolNFT structures on…

Component
V7G
Formula
C30 H35 N5 O5 S
Class
ligand
Structures
5
PDB entries
3

Binding sites

V7G in 5 structures; the first of them:

  • 6XR3 · X-ray Structure of SARS-CoV-2 main protease bound to GRL-024-20 at 1.45 A · V7G A401 · binds THR25, LEU27, HIS41, VAL42, MET49, PHE140, LEU141, ASN142 and 15 more
  • 7JKV · Crystal Structure of SARS-CoV-2 main protease in complex with an inhibitor GRL-2420 · V7G A401 · binds THR25, LEU27, HIS41, CYS44, MET49, PHE140, LEU141, ASN142 and 15 more
  • 9ART · Crystal structure of SARS-CoV-2 main protease A191T mutant in complex with an inhibitor 5h · V7G A401 · binds THR25, LEU27, HIS41, MET49, PHE140, LEU141, ASN142, GLY143 and 13 more
  • 6XR3 · X-ray structure of SARS-cov-2 main protease bound to grl-024-20 at 1.45 a · V7G A401 · binds THR25, LEU27, HIS41, VAL42, MET49, PHE140, LEU141, ASN142 and 15 more
  • 7JKV · Crystal structure of SARS-cov-2 main protease in complex with an inhibitor grl-2420 · V7G A401 · binds THR25, LEU27, HIS41, CYS44, MET49, PHE140, LEU141, ASN142 and 15 more

Residues it binds most

HIS 8, LEU 8, THR 8, MET 8, CYS 8, SER 8, ARG 8, ASN 8, ASP 8, GLN 8 (residue and the binding sites it lines).

Found with

  • 1PE · Pentaethylene glycol

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