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5GWY

Structure of Main Protease from Human Coronavirus NL63: Insights for Wide Spectrum Anti-Coronavirus Drug Design

Functional Information from GO Data
ChainGOidnamespacecontents
A0008233molecular_functionpeptidase activity
A0019082biological_processviral protein processing
B0008233molecular_functionpeptidase activity
B0019082biological_processviral protein processing
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR CHAIN D OF N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~- ((1R,2Z)-4-(BENZYLOXY)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3- YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
ChainResidue
BSER1
BGLN164
BILE165
BGLU166
BGLY168
BHIS172
BPRO189
BSER190
BLEU191
BLYS254
BMET297
BTHR25
BHOH444
BHOH446
BHOH461
DHOH101
BVAL26
BTHR47
BILE51
BPHE139
BGLY142
BCYS144
BHIS163

site_idAC2
Number of Residues21
DetailsBINDING SITE FOR CHAIN E OF N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~- ((1R,2Z)-4-(BENZYLOXY)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3- YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
ChainResidue
AVAL26
ALEU27
AHIS41
APHE139
AGLY142
ACYS144
AHIS163
AGLN164
AILE165
AGLU166
AGLY168
AASP187
APRO189
ASER190
ALEU191
AHOH522
BLEU-2
BLEU191
BGLU194
EHOH101
EHOH102

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsACT_SITE: For 3CL-PRO activity => ECO:0000255|PROSITE-ProRule:PRU00772
ChainResidueDetails
AHIS41
ACYS144
BHIS41
BCYS144

site_idSWS_FT_FI2
Number of Residues2
DetailsSITE: Cleavage; by 3CL-PRO => ECO:0000250
ChainResidueDetails
AGLN303
BGLN303

224201

PDB entries from 2024-08-28

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