GL1X · GenesisL1 explorer

Ligand · BOI

BOI · [[(2~{R},3~{S},4~{R},5~{R})-5-[(4~{E})-4-[(4-chlorophenyl)methoxyimino]-3-methyl-2-oxidanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]methylphosphonic acid

BOI, [[(2~{R},3~{S},4~{R},5~{R})-5-[(4~{E})-4-[(4-chlorophenyl)methoxyimino]-3-methyl-2-oxidanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]methylphosphonic acid (C18 H24 Cl N3 O11 P2, 555.8 g/mol), in…

Component
BOI
Formula
C18 H24 Cl N3 O11 P2
Class
ligand
Structures
3
PDB entries
2

Binding sites

BOI in 3 structures; the first of them:

  • 7QGA · Human CD73 (ecto 5'-nucleotidase) in complex with MRS4598 (a 3-methyl-CMPCP derivative… · BOI A604 · binds ASP47, SER49, ARG354, ASN390, GLY392, GLY393, ARG395, PRO416 and 4 more
  • 7QGA · Human CD73 (ecto 5'-nucleotidase) in complex with MRS4598 (a 3-methyl- cmpcp derivative… · BOI A604 · binds ASP47, SER49, ARG354, ASN390, GLY392, GLY393, ARG395, PHE417 and 3 more
  • 7QGM · Human CD73 (ecto 5'-nucleotidase) in complex with MRS4598 (a 3-methyl- cmpcp derivative… · BOI A604 · binds HIS38, ASP85, GLN88, ASN117, HIS118, ASP121, LEU184, ASN186 and 11 more

Residues it binds most

GLY 3, ASP 3, ARG 3, ASN 3, PHE 3, HIS 1, SER 2, GLN 1, LEU 1, PRO 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • PG4 · Tetraethylene glycol

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