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sc-PDB

An Annotated Database of Druggable Binding Sites from the Protein DataBank

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Distribution of Cavity similarities measured by Shaper
You can zoom onto the graph by using the mouse to make a selection

Cavities are compared using Shaper.
For more information, please see the following publication: Desaphy J. et al. Comparison and Druggability Prediction of protein-Ligand Binding sites from pharmacophore-annotated cavity shapes J. Chem. Inf. Model., 2012, 52(8), pp2287-2299

Reference Protein Data Bank Entry :
PDB ID HET Uniprot Name EC Number
4psgNOHThymidylate synthase

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
4psgNOHThymidylate synthase/1.000
4irrUMPThymidylate synthase/0.574
4eb4UMPThymidylate synthase2.1.1.450.569
5by6UMPThymidylate synthase/0.556
3qj7UMPThymidylate synthase ThyA/0.554
4e5oUMPThymidylate synthase2.1.1.450.546
4h0uUMPThymidylate synthase/0.546
1bidUMPThymidylate synthase/0.523
3dg8UMPBifunctional dihydrofolate reductase-thymidylate synthase1.5.1.30.521
4xsdUMPThymidylate synthase2.1.1.450.520
3hb8UMPThymidylate synthase2.1.1.450.516
1ci7UMPThymidylate synthase2.1.1.450.512
3dgaUMPBifunctional dihydrofolate reductase-thymidylate synthase1.5.1.30.510
4einNOHThymidylate synthase2.1.1.450.509
1tsxUMPThymidylate synthase/0.508
2g86UMPThymidylate synthase/0.507
1jmgUMPThymidylate synthase/0.498
4dpdUMPBifunctional dihydrofolate reductase-thymidylate synthase/0.493
1njaDCMThymidylate synthase/0.489
1aobDDUThymidylate synthase/0.488
1bp6UMPThymidylate synthase/0.486
1njbUMPThymidylate synthase/0.486
2g89UMPThymidylate synthase/0.486
1bduDURThymidylate synthase/0.478
1an5CB3Thymidylate synthase/0.477
1f4eTPRThymidylate synthase/0.476
4dq1UMPThymidylate synthase/0.474
1vzdCB3Thymidylate synthase/0.473
2vetUMPThymidylate synthase/0.465
1vzbUMPThymidylate synthase/0.464
1jmhUMPThymidylate synthase/0.463
1njdUMPThymidylate synthase/0.463
3bgxTMPThymidylate synthase/0.462
1tsvUMPThymidylate synthase/0.461
1njcDCMThymidylate synthase/0.460
1thyUMPThymidylate synthase/0.460
1dduDDUThymidylate synthase/0.456
1jmiUMPThymidylate synthase/0.454
1tsyUMPThymidylate synthase/0.453
4fogC2FThymidylate synthase ThyA/0.451
1njeDCMThymidylate synthase/0.449
3bgxMEFThymidylate synthase/0.447
4foxUMPThymidylate synthase ThyA/0.447
1lcbTMPThymidylate synthase/0.444
4lrrCF9Thymidylate synthase/0.443
3bhlTHGThymidylate synthase/0.442
1lcbDHFThymidylate synthase/0.440