L. CASEI THYMIDYLATE SYNTHASE WITH SPECIES SPECIFIC INHIBITOR
PDB id Source Resolution
1TSL LACTOBACILLUS CASEI 2.5 angstroms
Ligand Information
Ligand Validity Binding
Data		 Ligand
Warnings		 Eolus Viewer
(click picture
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Viewer		 Molecular
Weight
(Da)		 Formula SMILES
A15 Valid ki =  0.7 uM   launch gocavviewer-lite   437.272
C24 H14 Cl2 O4
 c1cc2cccc3c2c(c1)C(=O)OC3(c4ccc(c(c4)Cl)O)c5ccc(c(c5)Cl)O
PO4 Invalid            

STRUCTURE-BASED DESIGN OF INHIBITORS SPECIFIC FOR BACTERIAL THYMIDYLATE SYNTHASE TO BE PUBLISHED

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90% Homology Family

The Class containing this family consists of a total of 5 families.
Leader:    2G86
L. CASEI THYMIDYLATE SYNTHASE Y261F IN COMPLEX WITH
PDB id Binding data Representative ligand
2G86 Kd = 0.44 uM UMP
1BO7   U
1BO8   U
1BP0 kd = 4.0 uM UMP
1BP6   UMP
1BPJ   UMP
1JMF kd = 1.7 uM UMP
1JMG kd = 0.85 uM UMP
1JMH   UMP
1JMI kd = 0.87 uM UMP
1LCA   UMP
1LCB   TMP
1LCE   UMP
1NJA kd = 0.49 uM DCM
1NJC kd = 2.8 uM DCM
1NJD kd = 2.7 uM UMP
1NJE kd = 160.0 uM DCM
1TSL ki = 0.7 uM A15
1TSX   UMP
1TSY kd = 11.0 uM UMP
1TVU   UMP
1TVV   UMP
1TVW   UMP
1VZA   UMP
1VZB   UMP
1VZC   UFP
1VZD   UFP
1VZE   CB3
2G89   UMP
2G8A   UMP
2G8D   UMP