Ligand · S5J
S5J · 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanenitrile
S5J, 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanenitrile (C13 H17 N3 O, 231.3 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…
- Component
- S5J
- Formula
- C13 H17 N3 O
- Class
- ligand
- Structures
- 3
- PDB entries
- 2
Binding sites
S5J in 3 structures; the first of them:
- 5SM5 · PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 NSP14 in complex with… · S5J D606 · binds ARG310, LYS311, GLN313, HIS314, ILE338, LYS339, CYS340, PRO342
- 5RAQ · Pandda analysis group deposition -- crystal structure of JMJD1B in complex with FM001577A · S5J A1801 · binds SER1383, HIS1394, SER1418, VAL1598, ARG1602, HIS1606, GLU1608
- 5SM5 · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP14 in complex with… · S5J D606 · binds ARG310, LYS311, GLN313, HIS314, ILE338, LYS339, CYS340, PRO342
Residues it binds most
HIS 4, ARG 4, LYS 2, CYS 3, SER 2, GLN 2, GLU 2, ILE 2, PRO 2, VAL 2 (residue and the binding sites it lines).
Found with
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