Browse entries in the PDBbind-CN Database

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Related entries of code: 2onb
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1hvyRCSB PDB    PDBbind288aa, >1HVY_1|Chains... at 100%
1i00RCSB PDB    PDBbind290aa, >1I00_1|Chains... at 97%
1jujRCSB PDB    PDBbind313aa, >1JUJ_1|Chains... at 99%
3h9kRCSB PDB    PDBbind313aa, >3H9K_1|Chains... at 99%
3hb8RCSB PDB    PDBbind313aa, >3HB8_1|Chains... at 99%
3n5eRCSB PDB    PDBbind325aa, >3N5E_1|Chain... at 100%
4e28RCSB PDB    PDBbind325aa, >4E28_1|Chain... at 100%
4fgtRCSB PDB    PDBbind325aa, >4FGT_1|Chain... at 99%
6pf6RCSB PDB    PDBbind290aa, >6PF6_1|Chains... at 97%
6pf5RCSB PDB    PDBbind290aa, >6PF5_1|Chains... at 97%
6pf4RCSB PDB    PDBbind290aa, >6PF4_1|Chains... at 97%
6pf3RCSB PDB    PDBbind290aa, >6PF3_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID2onb
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameThymidylate synthetase
Ligand Name7PA
EC.Number E.C.2.1.1.45
Resolution 2.7(Å)
Affinity (Kd/Ki/IC50)Ki=2.7uM
Release Year2007
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry 46: 2823-2830
Ligand Properties
Formula C3H12O6P2
Molecular Weight 206.071
Exact Mass 206.011
No. of atoms 23
No. of bonds 22
Polar Surface Area 148.56
LOGP Value -3.39      (Computed with XLOGP3)
-1.14      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 0
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P04818  
Entrez Gene IDNCBI Entrez Gene ID: 7298  
ASDInformation of known allosteric effects of PDB entries

 
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