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Related entries of code: 6qzh
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2ya6RCSB PDB    PDBbind493aa, >2YA6_1|Chains... at 95%
2ya7RCSB PDB    PDBbind493aa, >2YA7_1|Chains... at 95%
2ya8RCSB PDB    PDBbind493aa, >2YA8_1|Chains... at 95%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID6qzh
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namehuman CC Chemokine Receptor 7
Ligand NameJLW
EC.Number E.C.-.-.-.-
Resolution 2.1(Å)
Affinity (Kd/Ki/IC50)Kd=3nM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2019) Cell Vol. 178: pp. 1222-1230.e10
Ligand Properties
Formula C22H29N5O5S
Molecular Weight 475.561
Exact Mass 475.189
No. of atoms 62
No. of bonds 64
Polar Surface Area 144.98
LOGP Value 3.28      (Computed with XLOGP3)
3.56      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 3
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): P32248  
Entrez Gene IDNCBI Entrez Gene ID: 1236  
ASDInformation of known allosteric effects of PDB entries
 
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