Browse entries in the PDBbind-CN Database

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Related entries of code: 5tuo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4ygfRCSB PDB    PDBbind234aa, >4YGF_1|Chains... *
4yhaRCSB PDB    PDBbind234aa, >4YHA_1|Chains... at 100%
5tt3RCSB PDB    PDBbind234aa, >5TT3_1|Chains... at 100%
5tt8RCSB PDB    PDBbind234aa, >5TT8_1|Chains... at 100%
5tv3RCSB PDB    PDBbind234aa, >5TV3_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2hncRCSB PDB    PDBbind1SA

Entry Information
PDB ID5tuo
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameAlpha-carbonic anhydrase
Ligand Name1SA
EC.Number E.C.-.-.-.-
Resolution 2.5(Å)
Affinity (Kd/Ki/IC50)Ki=323nM
Release Year2017
Protein/NA SequenceCheck fasta file
Primary Reference (2016) J. Med. Chem. Vol. 59: pp. 11098-11109
Ligand Properties
Formula C2H4N4O2S2
Molecular Weight 180.209
Exact Mass 179.978
No. of atoms 14
No. of bonds 14
Polar Surface Area 148.58
LOGP Value -1.08      (Computed with XLOGP3)
1.13      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 1
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): A0A0M3KL20  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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