Browse entries in the PDBbind-CN Database

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Related entries of code: 6cex
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1hgeRCSB PDB    PDBbind328aa, >1HGE_1|Chains... at 99%
1hgiRCSB PDB    PDBbind328aa, >1HGI_1|Chains... at 100%
1hgjRCSB PDB    PDBbind328aa, >1HGJ_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2vw2RCSB PDB    PDBbindNHE
4hwbRCSB PDB    PDBbindNHE
5ct1RCSB PDB    PDBbindNHE
6cf5RCSB PDB    PDBbindNHE
Entry Information
PDB ID6cex
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameHemagglutinin
Ligand NameNHE
EC.Number E.C.-.-.-.-
Resolution 2.57(Å)
Affinity (Kd/Ki/IC50)Kd=20mM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Proc. Natl. Acad. Sci. U.S.A. Vol. 115: pp. 4240-4245
Ligand Properties
Formula C8H20NO3S
Molecular Weight 210.314
Exact Mass 210.116
No. of atoms 33
No. of bonds 33
Polar Surface Area 102.6
LOGP Value -1.15      (Computed with XLOGP3)
1.11      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 4
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): P03436  Q91MA7  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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