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1LVO

Structure of coronavirus main proteinase reveals combination of a chymotrypsin fold with an extra alpha-helical domain

Functional Information from GO Data
ChainGOidnamespacecontents
A0008233molecular_functionpeptidase activity
A0019082biological_processviral protein processing
B0008233molecular_functionpeptidase activity
B0019082biological_processviral protein processing
C0008233molecular_functionpeptidase activity
C0019082biological_processviral protein processing
D0008233molecular_functionpeptidase activity
D0019082biological_processviral protein processing
E0008233molecular_functionpeptidase activity
E0019082biological_processviral protein processing
F0008233molecular_functionpeptidase activity
F0019082biological_processviral protein processing
Functional Information from PDB Data
site_idAC1
Number of Residues1
DetailsBINDING SITE FOR RESIDUE SO4 C 3001
ChainResidue
CGLU179

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 C 3002
ChainResidue
CARG130
CASN196

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 3003
ChainResidue
AASN168
ALEU192
AGLU193
AGLY194
AHOH4029

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 3004
ChainResidue
ALYS136
AASN196
AHOH4135
AARG130

site_idAC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 C 3005
ChainResidue
CASN168
CLEU192
CGLU193
CGLY194
CHOH4077

site_idAC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 3006
ChainResidue
BASN168
BGLU193
BGLY194
BHOH4075
BHOH4158

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 E 3007
ChainResidue
BHOH4178
EASN168
ELEU192
EGLU193
EGLY194

site_idAC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 D 3008
ChainResidue
DARG130
DASN196
DHOH4083

site_idAC9
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 E 3009
ChainResidue
EARG130
EHOH4100
EHOH4184
EHOH4210

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 F 3010
ChainResidue
FASN168
FLEU192
FGLU193
FGLY194

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 3011
ChainResidue
AGLY214
AGLU215
AARG216
ATRP217

site_idBC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 D 3012
ChainResidue
DASN168
DLEU192
DGLU193
DGLY194
DHOH4026

site_idBC4
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 E 3013
ChainResidue
EARG275
ETHR276
EHOH4094

site_idBC5
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 C 3015
ChainResidue
CARG275
CTHR276

site_idBC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 D 3016
ChainResidue
DGLY214
DARG216
DTRP217
DHOH4168

site_idBC7
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 D 3017
ChainResidue
DARG275
DTHR276

site_idBC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 E 3018
ChainResidue
EVAL60
EARG61
ELEU62
EHIS63

site_idBC9
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 F 3019
ChainResidue
FARG216
FTRP217
FDIO2003

site_idCC1
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 B 3020
ChainResidue
BLYS82
BPHE102
BPHE176

site_idCC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 D 3021
ChainResidue
CARG294
DALA115
DSER123

site_idCC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 3022
ChainResidue
ALYS103
ASER104

site_idCC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 C 3023
ChainResidue
CGLY214
CGLU215
CARG216
CTRP217
CARG275
CHOH4035

site_idCC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 F 3024
ChainResidue
FARG61
FLEU62
FHIS63

site_idCC6
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 F 3025
ChainResidue
FARG130
FLYS136
FASN196

site_idCC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 B 3026
ChainResidue
BARG19
BSER21
BHOH4070
BHOH4116

site_idCC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 3027
ChainResidue
AARG19
ASER21
AVAL26

site_idCC9
Number of Residues7
DetailsBINDING SITE FOR RESIDUE DIO E 2001
ChainResidue
BGLY273
EARG216
ETRP217
EHOH4063
EHOH4132
EHOH4229
EHOH4230

site_idDC1
Number of Residues3
DetailsBINDING SITE FOR RESIDUE DIO E 2002
ChainResidue
ESER123
EHOH4185
FMET6

site_idDC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DIO F 2003
ChainResidue
FGLY274
FARG275
FTHR276
FSO43019

site_idDC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE DIO A 2004
ChainResidue
AASN112
AGLU291

site_idDC4
Number of Residues3
DetailsBINDING SITE FOR RESIDUE DIO A 2005
ChainResidue
ASER131
AGLN132
AGLY133

site_idDC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE DIO A 2006
ChainResidue
AGLY122
ASER123
AHOH4112

site_idDC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DIO B 2007
ChainResidue
BPHE139
BCYS144
BHIS162
BGLU165

site_idDC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DIO C 2008
ChainResidue
CSER223
CMET224
CSER225
CSER228

site_idDC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DIO C 2009
ChainResidue
CLYS136
CHOH4124
DGLY2
DASN213

site_idDC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MRD A 4001
ChainResidue
AHIS41
AHIS163
ALEU164
AGLN187
APRO188

site_idEC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MRD B 4002
ChainResidue
BHIS41
BTHR47
BILE51
BTYR53
BLEU164
BASP186
BHOH4192

site_idEC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MRD C 4003
ChainResidue
CHIS41
CTHR47
CILE51
CTYR53
CLEU164
CASP186

site_idEC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MRD D 4004
ChainResidue
DHIS41
DILE51
DTYR53
DLEU164
DASP186
DGLN187
DPRO188

site_idEC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MRD E 4005
ChainResidue
EHIS41
ETHR47
EHIS163
ELEU164
EASP186
EGLN187
EHOH4045

site_idEC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MRD F 4006
ChainResidue
FHIS41
FTHR47
FASP186
FGLN187
FPRO188

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues12
DetailsACT_SITE: For 3CL-PRO activity => ECO:0000255|PROSITE-ProRule:PRU00772
ChainResidueDetails
AHIS41
ECYS144
FHIS41
FCYS144
ACYS144
BHIS41
BCYS144
CHIS41
CCYS144
DHIS41
DCYS144
EHIS41

site_idSWS_FT_FI2
Number of Residues6
DetailsSITE: Cleavage; by 3CL-PRO => ECO:0000250
ChainResidueDetails
AGLN302
BGLN302
CGLN302
DGLN302
EGLN302
FGLN302

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
ACYS144
AHIS41

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
BCYS144
BHIS41

site_idCSA3
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
CCYS144
CHIS41

site_idCSA4
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
DCYS144
DHIS41

site_idCSA5
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
ECYS144
EHIS41

site_idCSA6
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
FCYS144
FHIS41

226707

PDB entries from 2024-10-30

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