Browse entries in the PDBbind-CN Database

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Related entries of code: 4std
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1stdRCSB PDB    PDBbind172aa, >1STD_1|Chain... *
2stdRCSB PDB    PDBbind172aa, >2STD_1|Chain... at 100%
3stdRCSB PDB    PDBbind165aa, >3STD_1|Chains... at 98%
5stdRCSB PDB    PDBbind164aa, >5STD_1|Chains... at 99%
6stdRCSB PDB    PDBbind164aa, >6STD_1|Chains... at 99%
7stdRCSB PDB    PDBbind164aa, >7STD_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1stdRCSB PDB    PDBbindBFS

Entry Information
PDB ID4std
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namescytalone dehydratase
Ligand NameBFS
EC.Number E.C.4.2.1.94
Resolution 2.15(Å)
Affinity (Kd/Ki/IC50)Ki=47pM
Release Year1999
Protein/NA SequenceCheck fasta file
Primary Reference Proteins v35 pp. 425-39, 1999
Ligand Properties
Formula C15H13BrFNO2
Molecular Weight 338.172
Exact Mass 337.011
No. of atoms 33
No. of bonds 34
Polar Surface Area 49.33
LOGP Value 4.08      (Computed with XLOGP3)
4.18      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 3
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): P56221  
Entrez Gene IDNCBI Entrez Gene ID: 2675492  
ASDInformation of known allosteric effects of PDB entries

 
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