Browse entries in the PDBbind-CN Database

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Related entries of code: 3n1c
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3umoRCSB PDB    PDBbind309aa, >3UMO_1|Chains... at 100%
3umpRCSB PDB    PDBbind309aa, >3UMP_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1mtoRCSB PDB    PDBbindF6P
3bxhRCSB PDB    PDBbindF6P
4r74RCSB PDB    PDBbindF6P

Entry Information
PDB ID3n1c
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Name6-phosphofructokinase isozyme 2,Pfk-2
Ligand NameF6P
EC.Number E.C.2.7.1.11
Resolution 2(Å)
Affinity (Kd/Ki/IC50)Kd=6uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2011) J.Biol.Chem. Vol. 286: pp. 5774-5783
Ligand Properties
Formula C6H14O9P
Molecular Weight 261.144
Exact Mass 261.038
No. of atoms 30
No. of bonds 30
Polar Surface Area 173.66
LOGP Value -4.09      (Computed with XLOGP3)
-3.54      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
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): P06999  
Entrez Gene IDNCBI Entrez Gene ID: 946230  
ASDInformation of known allosteric effects of PDB entries

 
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