Ligand · JSI
JSI · [(~{E})-2-[5-bromanyl-2-[(4-oxidanylidene-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)sulfanyl]phenyl]ethenyl]phosphonic acid
JSI, [(~{E})-2-[5-bromanyl-2-[(4-oxidanylidene-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)sulfanyl]phenyl]ethenyl]phosphonic acid (C14 H11 Br N3 O4 P S, 428.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries).…
- Component
- JSI
- Formula
- C14 H11 Br N3 O4 P S
- Class
- ligand
- Structures
- 2
- PDB entries
- 2
Binding sites
JSI in 2 structures; the first of them:
- 7ZSN · human purine nucleoside phosphorylase in complex with JS-379 · JSI A301 · binds GLY32, SER33, ARG84, HIS86, ASN115, ALA116, ALA117, GLY118 and 12 more
- 7ZSR · purine nucleoside phosphorylase in complex with JS-379 · JSI A301 · binds GLY35, SER36, GLY37, ARG88, HIS90, TYR92, THR118, ASN119 and 17 more
Residues it binds most
GLY 4, ALA 4, ASN 4, HIS 4, SER 4, VAL 4, TYR 3, LEU 4, THR 4, ARG 4 (residue and the binding sites it lines).
Found with
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