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8DEA

Scaffold Hopping via Ring Opening Enables Identification of Acyclic Compounds as New Complement Factor D Inhibitors

Functional Information from GO Data
ChainGOidnamespacecontents
A0004252molecular_functionserine-type endopeptidase activity
A0005576cellular_componentextracellular region
A0005615cellular_componentextracellular space
A0006508biological_processproteolysis
A0006956biological_processcomplement activation
A0006957biological_processcomplement activation, alternative pathway
A0008236molecular_functionserine-type peptidase activity
A0009617biological_processresponse to bacterium
A0031093cellular_componentplatelet alpha granule lumen
A0034774cellular_componentsecretory granule lumen
A0070062cellular_componentextracellular exosome
A1904813cellular_componentficolin-1-rich granule lumen
B0004252molecular_functionserine-type endopeptidase activity
B0005576cellular_componentextracellular region
B0005615cellular_componentextracellular space
B0006508biological_processproteolysis
B0006956biological_processcomplement activation
B0006957biological_processcomplement activation, alternative pathway
B0008236molecular_functionserine-type peptidase activity
B0009617biological_processresponse to bacterium
B0031093cellular_componentplatelet alpha granule lumen
B0034774cellular_componentsecretory granule lumen
B0070062cellular_componentextracellular exosome
B1904813cellular_componentficolin-1-rich granule lumen
C0004252molecular_functionserine-type endopeptidase activity
C0005576cellular_componentextracellular region
C0005615cellular_componentextracellular space
C0006508biological_processproteolysis
C0006956biological_processcomplement activation
C0006957biological_processcomplement activation, alternative pathway
C0008236molecular_functionserine-type peptidase activity
C0009617biological_processresponse to bacterium
C0031093cellular_componentplatelet alpha granule lumen
C0034774cellular_componentsecretory granule lumen
C0070062cellular_componentextracellular exosome
C1904813cellular_componentficolin-1-rich granule lumen
D0004252molecular_functionserine-type endopeptidase activity
D0005576cellular_componentextracellular region
D0005615cellular_componentextracellular space
D0006508biological_processproteolysis
D0006956biological_processcomplement activation
D0006957biological_processcomplement activation, alternative pathway
D0008236molecular_functionserine-type peptidase activity
D0009617biological_processresponse to bacterium
D0031093cellular_componentplatelet alpha granule lumen
D0034774cellular_componentsecretory granule lumen
D0070062cellular_componentextracellular exosome
D1904813cellular_componentficolin-1-rich granule lumen
Functional Information from PROSITE/UniProt
site_idPS00134
Number of Residues6
DetailsTRYPSIN_HIS Serine proteases, trypsin family, histidine active site. LSAAHC
ChainResidueDetails
ALEU37-CYS42

site_idPS00135
Number of Residues12
DetailsTRYPSIN_SER Serine proteases, trypsin family, serine active site. DSckGDSGGPLV
ChainResidueDetails
AASP177-VAL188

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues12
DetailsACT_SITE: Charge relay system
ChainResidueDetails
AHIS41
DHIS41
DASP89
DSER183
AASP89
ASER183
BHIS41
BASP89
BSER183
CHIS41
CASP89
CSER183

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PDB entries from 2024-07-10

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