Ligand · OS8
OS8 · (4~{R})-~{N}-[3-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)propyl]-4-methyl-2-oxidanylidene-1,3,4,5-tetrahydro-1,5-benzodiazepine-6-carboxamide
OS8, (4~{R})-~{N}-[3-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)propyl]-4-methyl-2-oxidanylidene-1,3,4,5-tetrahydro-1,5-benzodiazepine-6-carboxamide (C24 H30 N4 O3, 422.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2…
- Component
- OS8
- Formula
- C24 H30 N4 O3
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
OS8 in 4 structures; the first of them:
- 6YIM · Crystal structure of the CREBBP bromodomain in complex with a benzo-diazepine ligand · OS8 A1201 · binds LEU1109, PRO1110, PHE1111, VAL1115, LEU1120, ILE1122, TYR1125, ALA1164 and 5 more
- 6YIN · Crystal structure of the first bromodomain of BRD4 in complex with a benzo-diazepine… · OS8 A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LYS91, LEU92, LEU94 and 5 more
- 6YIM · Crystal structure of the crebbp bromodomain in complex with a benzo- diazepine ligand · OS8 A1201 · binds LEU1109, PRO1110, PHE1111, VAL1115, LEU1120, ILE1122, TYR1125, ALA1164 and 5 more
- 6YIN · Crystal structure of the first bromodomain of BRD4 in complex with a benzo-diazepine… · OS8 A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LYS91, LEU92, LEU94 and 5 more
Residues it binds most
LEU 4, TYR 4, PHE 4, VAL 4, ASN 4, ILE 4, PRO 4, ALA 2, ARG 2, CYS 2 (residue and the binding sites it lines).
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