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Ligand · BS5

BS5 · 5'-deoxy-5'-[({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}sulfamoyl)amino]adenosine

BS5, 5'-deoxy-5'-[({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}sulfamoyl)amino]adenosine (C20 H29 N9 O7 S2, 571.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding…

Component
BS5
Formula
C20 H29 N9 O7 S2
Class
ligand
Structures
2
PDB entries
2

Binding sites

BS5 in 2 structures; the first of them:

  • 3RUX · Crystal structure of biotin-protein ligase BirA from Mycobacterium tuberculosis in… · BS5 A1001 · binds SER38, THR39, ASN40, GLN63, GLY66, ARG67, GLY68, ARG69 and 21 more
  • 5I2F · Human Histidine Triad Nucleotide Binding Protein 1 (hHint1) with bound sulfamide… · BS5 A201 · binds TRP123, ILE18, PHE19, ILE22, PHE41, HIS42, ASP43, ILE44 and 10 more

Residues it binds most

GLY 3, ASN 3, ILE 3, ARG 2, GLN 3, SER 3, ASP 3, LEU 3, VAL 3, ALA 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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