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Ligand · 34B

34B · 2,4-diamino-5-(1-O-carboranylmethyl)-6-methylpyrimidine

34B, 2,4-diamino-5-(1-O-carboranylmethyl)-6-methylpyrimidine (C8 H20 B10 N4, 280.4 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 residues it binds…

Component
34B
Formula
C8 H20 B10 N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

34B in 2 structures; the first of them:

  • 2C2S · Human Dihydrofolate Reductase Complexed With NADPH and… · 34B A1188 · binds ILE7, VAL8, ALA9, LEU22, GLU30, PHE31, PHE34, THR56 and 6 more
  • 2C2S · Human dihydrofolate reductase complexed with NADPH and 2,4-diamino-5… · 34B A1188 · binds ILE7, VAL8, ALA9, LEU22, GLU30, PHE31, PHE34, THR56 and 6 more

Residues it binds most

ILE 4, LEU 4, PHE 4, THR 4, VAL 4, ALA 4, GLU 4, SER 4, TYR 4 (residue and the binding sites it lines).

Found with

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate
  • GOL · Glycerol

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