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Ligand · XND

XND · (11R)-10-acetyl-11-(2,4-dichlorophenyl)-6-hydroxy-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

XND, (11R)-10-acetyl-11-(2,4-dichlorophenyl)-6-hydroxy-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one (C23 H22 Cl2 N2 O3, 445.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
XND
Formula
C23 H22 Cl2 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

XND in 2 structures; the first of them:

  • 3GOL · HCV NS5b polymerase in complex with 1,5 benzodiazepine inhibitor (R)-11d · XND A579 · binds PHE193, ARG200, ASN316, ASP319, CYS366, SER367, SER368, LEU384 and 11 more
  • 3GOL · HCV NS5B polymerase in complex with 1,5 benzodiazepine inhibitor (R)- 11D · XND A579 · binds PHE193, ARG200, ASN316, ASP319, CYS366, SER367, SER368, LEU384 and 11 more

Residues it binds most

SER 4, ARG 4, ASN 4, GLY 4, TYR 4, ASP 4, CYS 4, GLN 4, ILE 4, LEU 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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