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7BF6

Crystal structure of SARS-CoV-2 macrodomain in complex with remdesivir metabolite GS-441524

Functional Information from PDB Data
site_idAC1
Number of Residues16
Detailsbinding site for residue U08 A 201
ChainResidue
AASP22
AASP157
ALEU160
AEDO204
AHOH358
AHOH361
AHOH370
BMET171
AILE23
AVAL49
AGLU120
ALEU126
AALA129
AALA154
AVAL155
APHE156

site_idAC2
Number of Residues4
Detailsbinding site for residue EDO A 202
ChainResidue
ATYR161
AASP162
ASER166
AGLU170

site_idAC3
Number of Residues5
Detailsbinding site for residue EDO A 203
ChainResidue
AALA38
AASN40
AALA50
AHOH336
AHOH357

site_idAC4
Number of Residues4
Detailsbinding site for residue EDO A 204
ChainResidue
AGLU120
AGLY130
AU08201
BMET171

site_idAC5
Number of Residues13
Detailsbinding site for residue U08 B 201
ChainResidue
BASP22
BILE23
BVAL49
BALA52
BGLU120
BLEU126
BALA129
BALA154
BPHE156
BASP157
BLEU160
BHOH314
BHOH328

site_idAC6
Number of Residues14
Detailsbinding site for residue U08 C 201
ChainResidue
CASP22
CILE23
CVAL49
CGLU120
CLEU126
CALA129
CGLY130
CALA154
CPHE156
CASP157
CLEU160
CEDO203
CHOH310
CHOH314

site_idAC7
Number of Residues5
Detailsbinding site for residue EDO C 202
ChainResidue
AASN54
ALYS55
AASN59
CGLY8
CTYR9

site_idAC8
Number of Residues3
Detailsbinding site for residue EDO C 203
ChainResidue
CGLY130
CLEU160
CU08201

218853

PDB entries from 2024-04-24

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