Ligand · V8B
V8B · 6-methyl-3-[4-(2-oxidanylpropan-2-yl)phenyl]-4~{H}-pyrrolo[1,2-a]pyrazin-1-one
V8B, 6-methyl-3-[4-(2-oxidanylpropan-2-yl)phenyl]-4~{H}-pyrrolo[1,2-a]pyrazin-1-one (C17 H18 N2 O2, 282.3 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…
- Component
- V8B
- Formula
- C17 H18 N2 O2
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
V8B in 2 structures; the first of them:
- 7OCV · Human TNKS1 in complex with 3-[4-(1-Hydroxy-1-methyl-ethyl)-phenyl]-6-methyl-2H-pyrrolo[1… · V8B A1402 · binds PHE1183, HIS1184, GLY1185, SER1186, PRO1187, PHE1188, HIS1201, ALA1202 and 9 more
- 7OCV · Human TNKS1 in complex with 3-[4-(1-hydroxy-1-methyl-ethyl)-phenyl]-6… · V8B A1402 · binds PHE1183, HIS1184, GLY1185, SER1186, PHE1188, ALA1202, TYR1203, TYR1213 and 7 more
Residues it binds most
PHE 2, TYR 2, ALA 2, SER 2, HIS 2, GLU 2, GLY 2, ILE 2, LYS 2, PRO 1 (residue and the binding sites it lines).
Found with
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