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Related entries of code: 6std
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%
4stdRCSB PDB    PDBbind164aa, >4STD_1|Chains... at 99%
5stdRCSB PDB    PDBbind164aa, >5STD_1|Chains... at 99%
7stdRCSB PDB    PDBbind164aa, >7STD_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID6std
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namescytalone dehydratase
Ligand NameMS2
EC.Number E.C.4.2.1.94
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Ki=2.3nM
Release Year1999
Protein/NA SequenceCheck fasta file
Primary Reference Proteins v35 pp. 425-39, 1999
Ligand Properties
Formula C14H16BrCl2NO2S
Molecular Weight 413.157
Exact Mass 410.946
No. of atoms 37
No. of bonds 38
Polar Surface Area 65.38
LOGP Value 3.01      (Computed with XLOGP3)
4.82      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
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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