Browse entries in the PDBbind-CN Database

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Related entries of code: 2isw
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2isvRCSB PDB    PDBbind323aa, >2ISV_1|Chains... *
3ohiRCSB PDB    PDBbind323aa, >3OHI_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1b57RCSB PDB    PDBbindPGH
1ik4RCSB PDB    PDBbindPGH
1tpwRCSB PDB    PDBbindPGH
1trdRCSB PDB    PDBbindPGH
2isvRCSB PDB    PDBbindPGH
2vxnRCSB PDB    PDBbindPGH
3c52RCSB PDB    PDBbindPGH
3taoRCSB PDB    PDBbindPGH
4delRCSB PDB    PDBbindPGH
Entry Information
PDB ID2isw
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NamePutative fructose-1,6-bisphosphate aldolase
Ligand NamePGH
EC.Number E.C.4.1.2.13
Resolution 1.75(Å)
Affinity (Kd/Ki/IC50)Ki=37nM
Release Year2006
Protein/NA SequenceCheck fasta file
Primary Reference J. Biol. Chem. 2007, 282, 4859-4867.
Ligand Properties
Formula C2H7NO6P
Molecular Weight 172.054
Exact Mass 172.001
No. of atoms 17
No. of bonds 16
Polar Surface Area 132.84
LOGP Value -2.86      (Computed with XLOGP3)
-1.45      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 0
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): O97447  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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