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Related entries of code: 1hsh
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1hiiRCSB PDB    PDBbind99aa, >1HII_1|Chains... *
1idaRCSB PDB    PDBbind99aa, >1IDA_1|Chains... at 100%
1idbRCSB PDB    PDBbind99aa, >1IDB_1|Chains... at 100%
1ivpRCSB PDB    PDBbind99aa, >1IVP_1|Chains... at 98%
1jldRCSB PDB    PDBbind99aa, >1JLD_1|Chains... at 100%
2mipRCSB PDB    PDBbind99aa, >2MIP_1|Chains... at 100%
3s45RCSB PDB    PDBbind99aa, >3S45_1|Chains... at 100%
5upjRCSB PDB    PDBbind99aa, >5UPJ_1|Chains... at 98%
6upjRCSB PDB    PDBbind99aa, >6UPJ_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1c6yRCSB PDB    PDBbindMK1
1hsgRCSB PDB    PDBbindMK1
1k6cRCSB PDB    PDBbindMK1
1sdtRCSB PDB    PDBbindMK1
1sduRCSB PDB    PDBbindMK1
1sdvRCSB PDB    PDBbindMK1
1sguRCSB PDB    PDBbindMK1
2avoRCSB PDB    PDBbindMK1
2avsRCSB PDB    PDBbindMK1
2avvRCSB PDB    PDBbindMK1
2bpxRCSB PDB    PDBbindMK1
2r5pRCSB PDB    PDBbindMK1
Entry Information
PDB ID1hsh
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameHIV-2 protease
Ligand NameMK1
EC.Number E.C.3.4.23.16
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=0.38nM
Release Year1996
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v269 pp. 26344-8, 1994
Ligand Properties
Formula C36H49N5O4
Molecular Weight 615.805
Exact Mass 615.378
No. of atoms 94
No. of bonds 98
Polar Surface Area 120.43
LOGP Value 2.79      (Computed with XLOGP3)
3.95      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
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): P04584  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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