Browse entries in the PDBbind-CN Database

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Related entries of code: 5tg7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3fv7RCSB PDB    PDBbind244aa, >3FV7_1|Chain... at 100%
3fyzRCSB PDB    PDBbind244aa, >3FYZ_1|Chain... at 100%
3fzcRCSB PDB    PDBbind244aa, >3FZC_1|Chain... at 100%
3mbzRCSB PDB    PDBbind244aa, >3MBZ_1|Chain... at 100%
4wm9RCSB PDB    PDBbind245aa, >4WM9_1|Chain... *
5tg4RCSB PDB    PDBbind245aa, >5TG4_1|Chain... at 98%
5tg5RCSB PDB    PDBbind245aa, >5TG5_1|Chain... at 99%
5tg6RCSB PDB    PDBbind245aa, >5TG6_1|Chain... at 99%
5vfdRCSB PDB    PDBbind244aa, >5VFD_1|Chain... at 100%
6b22RCSB PDB    PDBbind244aa, >6B22_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID5tg7
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameBeta-lactamase
Ligand NameJW3
EC.Number E.C.-.-.-.-
Resolution 2.28(Å)
Affinity (Kd/Ki/IC50)Ki=29.8uM
Release Year2017
Protein/NA SequenceCheck fasta file
Primary Reference (2017) Protein Sci. Vol. 26: pp. 515-526
Ligand Properties
Formula C12H12BNO4
Molecular Weight 245.039
Exact Mass 245.086
No. of atoms 30
No. of bonds 31
Polar Surface Area 82.7
LOGP Value 0.70      (Computed with XLOGP3)
0.28      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
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): Q8RLA6  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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