Ligand · DQ1
DQ1 · ethyl 4-(5-{[(2,4-diaminoquinazolin-6-yl)methyl]amino}-2-methoxyphenoxy)butanoate
DQ1, ethyl 4-(5-{[(2,4-diaminoquinazolin-6-yl)methyl]amino}-2-methoxyphenoxy)butanoate (C22 H27 N5 O4, 425.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…
- Component
- DQ1
- Formula
- C22 H27 N5 O4
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
DQ1 in 2 structures; the first of them:
- 3KJS · Crystal Structure of T. cruzi DHFR-TS with 3 high affinity DHFR inhibitors: DQ1 inhibitor… · DQ1 A602 · binds VAL26, VAL27, ALA28, ILE41, TRP43, ASN44, VAL45, ASP48 and 11 more
- 3KJS · Crystal structure of T. cruzi DHFR-ts with 3 high affinity DHFR inhibitors: DQ1 inhibitor… · DQ1 A602 · binds VAL26, VAL27, ALA28, ILE41, TRP43, ASN44, VAL45, ASP48 and 11 more
Residues it binds most
ILE 8, VAL 8, PHE 8, THR 8, ALA 8, ASN 8, ASP 8, LEU 8, MET 8, PRO 8 (residue and the binding sites it lines).
Found with
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