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Ligand · BBS

BBS · 4-tert-butylbenzenesulfonic acid

BBS, 4-tert-butylbenzenesulfonic acid (C10 H14 O3 S, 214.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
BBS
Formula
C10 H14 O3 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

BBS in 2 structures; the first of them:

  • 1EOJ · Design of P1' and P3' residues of trivalent thrombin inhibitors and their crystal… · BBS B1 · binds TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, TRP215, GLY216 and 4 more
  • 1EOL · Design of P1' and P3' residues of trivalent thrombin inhibitors and their crystal… · BBS B1 · binds TYR60A, TRP60D, GLU97A, LEU99, ILE174, TRP215, GLY216, GLU217 and 3 more

Residues it binds most

GLU 2, GLY 2, TRP 2, ARG 2, CPI 2, ILE 2, LEU 2, TYR 2, ASN 1 (residue and the binding sites it lines).

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