CRYSTAL STRUCTURE OF HUMAN DIHYDROFOLATE REDUCTASE COMPLEXED WITH FOLATE
PDB id Source Resolution
1DRF HOMO SAPIENS 2.0 angstroms
Ligand Information
Ligand Validity Binding
Data
Ligand
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Molecular
Weight
(Da)
Formula SMILES
FOL Valid Kd =  0.111 uM   launch gocavviewer-lite   441.397
C19 H19 N7 O6
c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCc2cnc3c(n2)C(=O)N=C(N3)N
SO4 Invalid            

CRYSTAL STRUCTURE OF HUMAN DIHYDROFOLATE REDUCTASE COMPLEXED WITH FOLATE. EUR.J.BIOCHEM. V. 174 377 1988

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90% Homology Family

The Class containing this family consists of a total of 22 families.

Leader:    1U72
UNDERSTANDING THE ROLE OF LEU22 VARIANTS IN METHOTREXATE
RESISTANCE: COMPARISON OF WILD-TYPE AND LEU22ARG
VARIANT M OUSE AND HUMAN DIHYDRFOLATE REDUCTASE
TERNARY CRYSTAL CO MPLEXES WITH METHOTREXATE AND NADPH
PDB id Binding data Representative ligand
1U72 Kd = 0.0034 nM MTX
1BOZ ic50 = 8500.0 nM PRD
1DHF Kd = 0.111 uM FOL
1DLR Ki = 16.4 nM MXA
1DLS Ki = 10.9 nM MTX
1DRF Kd = 0.111 uM FOL
1HFP Ki = 1036.0 nM MOT
1HFQ Ki = 2.7 nM MOT
1HFR Ki = 790.0 nM MOT
1KMS   LIH
1KMV   LII
1MVS   DTM
1MVT   DTM
1OHJ   NDP
1OHK   NDP
1PD8   NDP
1PD9   CO4
1S3U   TQD
1S3V   TQD
1S3W   NAP
1U71   MXA
2C2S ic50 = 0.15 uM 34B
2C2T ic50 = 15.0 uM 39E
2DHF   DZF
3EIG Ki = 21.0 nM MTX
3F8Y Ki = 8.3 nM DH1
3F8Z Ki = 66.0 nM DH1
3F91   DH1
3FS6 Ki = 230.0 nM DH1
3GHC   NDP
3GHV   NDP
3GHW Kd = 0.02 uM GHW
3GI2   GHW
3GYF ic50 = 12.3 nM 51P
3N0H Ki = 617.0 nM TOP
3NTZ ic50 = 0.09 uM 3TZ
3NU0 ic50 = 0.1 uM 3TU
3NXX Ki = 11.0 uM D2D
3NXY   NDP
3NZD   D2Q
3S3V Ki = 593.0 nM TOP
3S7A   684