Ligand · G82
G82 · Ethyl (5S,8S,11R)-8-benzyl-5-(3-tert-butoxy-3-oxopropyl)-3,6,9-trioxo-11-{[(3S)-2-oxopyrrolidin-3-yl]methyl}-1-phenyl-2-oxa-4,7,10-triazatetradecan-14-oate
G82, Ethyl (5S,8S,11R)-8-benzyl-5-(3-tert-butoxy-3-oxopropyl)-3,6,9-trioxo-11-{[(3S)-2-oxopyrrolidin-3-yl]methyl}-1-phenyl-2-oxa-4,7,10-triazatetradecan-14-oate (C37 H50 N4 O9, 694.8 g/mol), in the MolNFT structures on GenesisL1: bound in…
- Component
- G82
- Formula
- C37 H50 N4 O9
- Class
- ligand
- Structures
- 6
- PDB entries
- 3
Binding sites
G82 in 6 structures; the first of them:
- 3TIU · Crystal structure of SARS coronavirus main protease complexed with an… · G82 A501 · binds THR25, THR26, LEU27, HIS41, CYS44, MET49, TYR54, PHE140 and 18 more
- 3ZVC · 3C protease of Enterovirus 68 complexed with Michael receptor inhibitor 82 · G82 A1190 · binds LYS22, PHE25, PRO38, HIS40, ALA41, GLU71, LEU125, ASN126 and 13 more
- 3ZZ8 · Crystal structure of 3C protease of coxsackievirus B3 complexed with alpha… · G82 A1181 · binds TYR22, GLY23, GLU24, PHE25, ARG39, HIS40, GLU71, LEU125 and 15 more
- 3TIU · Crystal structure of SARS coronavirus main protease complexed with an… · G82 A501 · binds THR25, THR26, LEU27, HIS41, CYS44, MET49, TYR54, PHE140 and 18 more
- 3ZVC · 3C protease of enterovirus 68 complexed with michael receptor inhibitor 82 · G82 A1190 · binds LYS22, PHE25, PRO38, HIS40, ALA41, GLU71, LEU125, ASN126 and 13 more
- 3ZZ8 · Crystal structure of 3C protease of coxsackievirus B3 complexed with alpha… · G82 A1181 · binds TYR22, GLY23, GLU24, PHE25, ARG39, HIS40, GLU71, LEU125 and 15 more
Residues it binds most
GLY 6, HIS 6, LEU 6, ASN 6, THR 6, ALA 6, ARG 6, CYS 6, GLU 6, PHE 6 (residue and the binding sites it lines).
Found with
- DMS · Dimethyl sulfoxide
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