Ligand · 9DR
9DR · 6-ethyl-5-{3-[3-methoxy-5-(pyridin-4-yl)phenyl]prop-1-yn-1-yl}pyrimidine-2,4-diamine
9DR, 6-ethyl-5-{3-[3-methoxy-5-(pyridin-4-yl)phenyl]prop-1-yn-1-yl}pyrimidine-2,4-diamine (C21 H21 N5 O, 359.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within…
- Component
- 9DR
- Formula
- C21 H21 N5 O
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
9DR in 4 structures; the first of them:
- 3SAI · Bacuills anthracis Dihydrofolate Reductase bound to propargyl-linked TMP analog, UCP1015 · 9DR A163 · binds MET6, VAL7, ALA8, ASN20, LEU21, GLU28, LEU29, VAL32 and 9 more
- 4KD7 · Human dihydrofolate reductase complexed with NADPH and… · 9DR A202 · binds ILE7, VAL8, ALA9, ASP21, LEU22, GLU30, PHE31, PHE34 and 10 more
- 3SAI · Bacuills anthracis dihydrofolate reductase bound to propargyl-linked tmp analog, UCP1015 · 9DR A163 · binds MET6, VAL7, ALA8, ASN20, LEU21, GLU28, LEU29, VAL32 and 9 more
- 4KD7 · Human dihydrofolate reductase complexed with NADPH and 5-{3-[3… · 9DR A202 · binds ILE7, VAL8, ALA9, ASP21, LEU22, GLU30, PHE31, PHE34 and 10 more
Residues it binds most
LEU 8, VAL 8, ASN 8, ALA 8, ILE 8, PHE 8, THR 8, GLU 8, TYR 8, ARG 4 (residue and the binding sites it lines).
Found with
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