Ligand
Ligand Name:   METHOXYSUCCINYL-ALA-ALA-PRO-ALANINE BORONIC ACID
Ligand Type:   peptide-like
Ligand ID:   COVPDB527 PubChem:   74765856
Synonym(s):  
  •   meosu-ala-ala-pro-boroala
DrugBank:   - ChEMBL:   -
Canonical SMILES:   COC(=O)CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)B(O)O
Standard InChI:   InChI=1S/C18H31BN4O8/c1-10(20-14(24)7-8-15(25)31-4)16(26)21-11(2)18(28)23-9-5-6-13(23)17(27)22-12(3)19(29)30/h10-13,29-30H,5-9H2,1-4H3,(H,20,24)(H,21,26)(H,22,27)/t10-,11-,12-,13-/m0/s1
Molecular Formula:   C18H31BN4O8 Mol. Weight:   442.22348 logP:   -2.5433
HBD:   5 HBA:   8
#Rotatable Bonds:   10 TPSA:   174.37

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 1GBB B2A
-
-
SHOW
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 5LPR B2A
-
-
SHOW
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 1GBK B2A
-
-
SHOW
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 1P02 B2A
-
-
SHOW
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 1GBF B2A
-
-
SHOW