Browse entries in the PDBbind-CN Database

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Related entries of code: 3hiw
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3hitRCSB PDB    PDBbind259aa, >3HIT_1|Chains... *
3hivRCSB PDB    PDBbind259aa, >3HIV_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3hioRCSB PDB    PDBbindC2X

Entry Information
PDB ID3hiw
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameSaporin-L1
Ligand NameC2X
EC.Number E.C.3.2.2.22
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Ki=8.7nM
Release Year2009
Protein/NA SequenceCheck fasta file
Primary Reference (2009) Proc.Natl.Acad.Sci.USA Vol. 106: pp. 20276-20281
Ligand Properties
Formula C51H81N21O29P5
Molecular Weight 1607.180
Exact Mass 1606.420
No. of atoms 187
No. of bonds 199
Polar Surface Area 767.1
LOGP Value -7.02      (Computed with XLOGP3)
-0.62      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 19
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 50
No. of Rings: 13
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): Q2QEH4  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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