PDB Entry (5zeh)

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Visualizer: MichelaNGLo

PDB ID: 5zeh Resolution: 2.36 Å Exp. Method: X-RAY DIFFRACTION
PMID: 31199070 DOI: 10.1111/febs.14960
Protein
Protein Name: Arginase
Protein Class: HYDROLASE
Uniprot ID/ACC: C4LSS0 (C4LSS0_ENTHI) Organism: Entamoeba histolytica
Gene Symbol: - Gene ID: -
Pocket Descriptors
Volume: 333.76 Depth: 15.4827
Hydrophobicity: 0.625806 Drug Score: 0.263423
Pocket Similarity: Calculate
Ligand
Ligand Name:   L-ornithine
HET ID:   ORN PubChem:   6262, 88747248
DrugBank:   DB00129 ChEMBL:   CHEMBL446143
Canonical SMILES:   N[C@H](C(=O)O)CCCN
Standard InChI:   InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1
Molecular Formula:   C5H12N2O2 Mol. Weight:   132.16098 Heavy Atoms:   9
Charge:   0 Is Chiral:   True logP:   0.5378
HBD:   3 HBA:   4 TPSA:   89.34
#Bonds:   9 #Rotatable Bonds:   4 Shape Complexity:   0.8
Stereocomplexity:   0.2 Ligand Type:   Small Molecule
Binding Affinity
-