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Ligand · 3P1

3P1 · 8-[(quinolin-2-ylmethyl)amino]adenosine

3P1, 8-[(quinolin-2-ylmethyl)amino]adenosine (C20 H21 N7 O4, 423.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
3P1
Formula
C20 H21 N7 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

3P1 in 4 structures; the first of them:

  • 3LDP · Crystal structure of human GRP78 (70kDa heat shock protein 5 / BIP) ATPase domain in… · 3P1 A408 · binds THR38, TYR39, ILE61, GLY226, GLY227, GLY255, GLU256, ASP259 and 10 more
  • 3LDQ · Crystal structure of HSC70/BAG1 in complex with small molecule inhibitor · 3P1 A401 · binds GLY201, GLY202, GLY230, GLU231, GLU268, LYS271, ARG272, SER275 and 5 more
  • 3LDP · Crystal structure of human GRP78 (70KDA heat shock protein 5 / bip) ATPase domain in… · 3P1 A408 · binds THR38, TYR39, ILE61, GLY226, GLY227, GLY255, GLU256, ASP259 and 10 more
  • 3LDQ · Crystal structure of HSC70/BAG1 in complex with small molecule inhibitor · 3P1 A401 · binds GLY201, GLY202, GLY230, GLU231, GLU268, LYS271, ARG272, SER275 and 5 more

Residues it binds most

GLY 6, ARG 6, GLU 6, SER 6, ASP 6, ILE 6, LYS 6, THR 4, TYR 4, ASN 2 (residue and the binding sites it lines).

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