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1S3V

Structure Determination of Tetrahydroquinazoline Antifolates in Complex with Human and Pneumocystis carinii Dihydrofolate Reductase: Correlations of Enzyme Selectivity and Stereochemistry

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A
(A)
Dihydrofolate reductasepolymer18621349.51UniProt (P00374)
Pfam (PF00186)
Homo sapiens (human)
2B, C
(A)
SULFATE IONnon-polymer96.12Chemie (SO4)
3D
(A)
(2R,6S)-6-{[methyl(3,4,5-trimethoxyphenyl)amino]methyl}-1,2,5,6,7,8-hexahydroquinazoline-2,4-diaminenon-polymer375.51Chemie (TQD)
4E
(A)
waterwater18.0112Chemie (HOH)
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains1
Total formula weight21349.5
Non-Polymers*Number of molecules3
Total formula weight567.6
All*Total formula weight21917.1
*Water molecules are not included.

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PDB entries from 2024-11-06

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