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Ligand · CX0

CX0 · [(2~{R},3~{S},4~{R},5~{R})-5-[2,6-bis(azanyl)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate

CX0, [(2~{R},3~{S},4~{R},5~{R})-5-[2,6-bis(azanyl)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate (C10 H16 N6 O10 P2, 442.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries).…

Component
CX0
Formula
C10 H16 N6 O10 P2
Class
ligand
Structures
4
PDB entries
2

Binding sites

CX0 in 4 structures; the first of them:

  • 7EM3 · Crystal structure of the PI5P4Kbeta-2a-ATP complex · CX0 A501 · binds VAL148, THR201, ARG202, ASN203, VAL204, PHE205, ASP216, THR237 and 3 more
  • 7EM8 · Crystal structure of the PI5P4Kbeta T201M-2a-ATP complex · CX0 A501 · binds PHE139, VAL148, MET201, ARG202, ASN203, VAL204, PHE205, LYS214 and 3 more
  • 7EM3 · Crystal structure of the PI5P4KBETA-2A-ATP complex · CX0 A501 · binds VAL148, THR201, ARG202, ASN203, VAL204, PHE205, THR237, LEU282 and 2 more
  • 7EM8 · Crystal structure of the PI5P4KBETA T201M-2A-ATP complex · CX0 A501 · binds ARG202, ASN203, VAL204, PHE205, LYS214, LEU282, ILE368, ASP369

Residues it binds most

VAL 4, ASP 4, PHE 4, ARG 4, ASN 4, ILE 4, LEU 4, THR 2, LYS 2, MET 1 (residue and the binding sites it lines).

Found with

  • CXC · [[(2~{R},3~{S},4~{R},5~{R})-5-[2,6-bis(azanyl)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate

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