Browse entries in the PDBbind-CN Database

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Related entries of code: 4yw7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1okoRCSB PDB    PDBbind121aa, >1OKO_1|Chains... at 100%
2vxjRCSB PDB    PDBbind121aa, >2VXJ_1|Chains... at 100%
2wyfRCSB PDB    PDBbind121aa, >2WYF_1|Chains... at 100%
3zybRCSB PDB    PDBbind122aa, >3ZYB_1|Chains... *
3zyfRCSB PDB    PDBbind122aa, >3ZYF_1|Chains... at 100%
3zyhRCSB PDB    PDBbind122aa, >3ZYH_1|Chains... at 100%
4a6sRCSB PDB    PDBbind121aa, >4A6S_1|Chains... at 100%
4ljhRCSB PDB    PDBbind122aa, >4LJH_1|Chains... at 100%
4lk6RCSB PDB    PDBbind121aa, >4LK6_1|Chains... at 100%
4lk7RCSB PDB    PDBbind121aa, >4LK7_1|Chains... at 100%
4lkdRCSB PDB    PDBbind121aa, >4LKD_1|Chains... at 100%
4lkeRCSB PDB    PDBbind121aa, >4LKE_1|Chains... at 100%
4lkfRCSB PDB    PDBbind121aa, >4LKF_1|Chains... at 100%
4yw6RCSB PDB    PDBbind121aa, >4YW6_1|Chains... at 100%
4ywaRCSB PDB    PDBbind121aa, >4YWA_1|Chains... at 100%
5d21RCSB PDB    PDBbind121aa, >5D21_1|Chains... at 100%
5mihRCSB PDB    PDBbind121aa, >5MIH_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID4yw7
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NamePA-I galactophilic lectin
Ligand Name4J0
EC.Number E.C.-.-.-.-
Resolution 1.82(Å)
Affinity (Kd/Ki/IC50)Kd=130nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Acs Chem.Biol. Vol. 10: pp. 2455-2462
Ligand Properties
Formula C44H68N12O24
Molecular Weight 1149.080
Exact Mass 1148.450
No. of atoms 148
No. of bonds 156
Polar Surface Area 531.36
LOGP Value -12.15      (Computed with XLOGP3)
-10.81      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 25
No. of Rotatable Bonds: 38
No. of Nitrogen and Oxygen Atoms: 36
No. of Rings: 9
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): Q05097  
Entrez Gene IDNCBI Entrez Gene ID: 882335  
ASDInformation of known allosteric effects of PDB entries
 
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