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Ligand · B88

B88 · (2S)-2-{[(S)-[(1R)-1-aminoethyl](hydroxy)phosphoryl]methyl}butanedioic acid

B88, (2S)-2-{[(S)-[(1R)-1-aminoethyl](hydroxy)phosphoryl]methyl}butanedioic acid (C7 H14 N O6 P, 239.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
B88
Formula
C7 H14 N O6 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

B88 in 2 structures; the first of them:

  • 3ISI · Crystal structure of Sco3058 with bound inhibitor L-Ala-L-Asp Phosphinodipeptide · B88 X2000 · binds ASP22, TYR68, GLU123, HIS150, ASN151, HIS191, HIS212, ARG223 and 7 more
  • 3ISI · Crystal structure of SCO3058 with bound inhibitor L-ala-L-asp phosphinodipeptide · B88 X2000 · binds ASP22, TYR68, GLU123, HIS150, ASN151, HIS191, HIS212, ARG223 and 7 more

Residues it binds most

HIS 2, ASP 2, ARG 2, ASN 2, GLU 2, GLY 2, LYS 2, PHE 2, PRO 2, THR 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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