Browse entries in the PDBbind-CN Database

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Related entries of code: 5alc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
5albRCSB PDB    PDBbind216aa, >5ALB_2|Chain... at 92%
5c0sRCSB PDB    PDBbind221aa, >5C0S_3|Chain... *
5gznRCSB PDB    PDBbind216aa, >5GZN_3|Chains... at 95%
6pdxRCSB PDB    PDBbind215aa, >6PDX_3|Chains... at 92%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
5albRCSB PDB    PDBbindTIQ

Entry Information
PDB ID5alc
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameTicagrelor antidote candidate Fab 72
Ligand NameTIQ
EC.Number E.C.-.-.-.-
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)Kd=7.4nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Blood Vol. 125: pp. 3484-3490
Ligand Properties
Formula C23H28F2N6O4S
Molecular Weight 522.568
Exact Mass 522.186
No. of atoms 64
No. of bonds 68
Polar Surface Area 163.74
LOGP Value 2.03      (Computed with XLOGP3)
2.09      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
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 ACNo matched UniProt accession number (AC) found!
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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