GL1X · GenesisL1 explorer

Ligand · JS9

JS9 · 4-(2-{(4M)-4-[(6M)-6-(2,5-dimethoxyphenyl)pyridin-3-yl]-1H-1,2,3-triazol-1-yl}ethyl)-N-{[1-(methoxymethyl)cyclopropyl]methyl}-N-methylbenzamide

JS9, 4-(2-{(4M)-4-[(6M)-6-(2,5-dimethoxyphenyl)pyridin-3-yl]-1H-1,2,3-triazol-1-yl}ethyl)-N-{[1-(methoxymethyl)cyclopropyl]methyl}-N-methylbenzamide (C31 H35 N5 O4, 541.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1…

Component
JS9
Formula
C31 H35 N5 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

JS9 in 1 structure; the first of them:

  • 8TQV · Crystal Structure of Mtb Pks13 Thioesterase domain in complex with inhibitor X20403 · JS9 A1801 · binds ALA1477, SER1533, LEU1534, VAL1537, ASP1560, ALA1561, VAL1562, ARG1563 and 21 more

Residues it binds most

TYR 2, ALA 2, ASP 2, GLY 2, HIS 2, ILE 2, PHE 2, SER 2, VAL 2, ARG 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.