Structure of PDB 7ths Chain B Binding Site BS03

Receptor Information
>7ths Chain B (length=247) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AAPSFDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRTRFGMHFCGGT
LISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVPHVQEIEVSRLFLEPTR
KDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGA
GLLKEAQLPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDAGGP
LVCFEKDKYILQGVTSWGLGCARPNKPGVYVRVSRFVTWIEGVMRNN
Ligand information
Ligand IDI5Q
InChIInChI=1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3/t4-/m0/s1
InChIKeyBMRWNKZVCUKKSR-BYPYZUCNSA-N
SMILES
SoftwareSMILES
CACTVS 3.385CC[C@H](O)CO
CACTVS 3.385CC[CH](O)CO
ACDLabs 12.01CCC(O)CO
OpenEye OEToolkits 2.0.7CCC(CO)O
OpenEye OEToolkits 2.0.7CC[C@@H](CO)O
FormulaC4 H10 O2
Name(2S)-butane-1,2-diol
ChEMBL
DrugBank
ZINCZINC000001609005
PDB chain7ths Chain B Residue 805 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7ths Synthesis and Structural Characterization of Macrocyclic Plasmin Inhibitors.
Resolution1.8 Å
Binding residue
(original residue number in PDB)		Y713 E714 F715 N717 R719 K770
Binding residue
(residue number reindexed from 1)		Y169 E170 F171 N173 R175 K226
Annotation score1
Enzymatic activity
Enzyme Commision number 3.4.21.7: plasmin.
Gene Ontology
Molecular Function
GO:0004252 serine-type endopeptidase activity
Biological Process
GO:0006508 proteolysis

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Molecular Function
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Biological Process
External links
PDB RCSB:7ths, PDBe:7ths, PDBj:7ths
PDBsum7ths
PubMed36710259
UniProtP00747|PLMN_HUMAN Plasminogen (Gene Name=PLG)

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