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DOWNLOAD: [sequence-replaced 3D model] [for PyMOL] [3D template] [Modeller script]
ALL MOLECULES IN THE BIOLOGICAL UNIT: |
MOLECULES | contact sites | |||||
model | mark | query | asym_id oper (auth_asym_id) |
type | description | a(query A) |
1 | a | A(R1A_SARS2) | A 1 (A) | polymer(polypeptide(L)) [312 aa] | Papain-like protease nsp3 :R1AB_SARS2 | |
2 | b | B 1 (A) | non-polymer(XXW) | N-[(1R)-1-{(3M,5M)-3-[1-(difluoromethyl)-1H-pyrazol-4-yl]-5-[1-(methoxymethyl)-1H-pyrazol-4-yl]phenyl}ethyl]-5-[2-(dimethylamino)ethoxy]-2-methylbenzamide | 1725L 1726G 1727D 1730E 1771M 1810P 1811P 1827Y 1829G 1830N 1831Y 1832Q 1836Y 1864T (identity: 100.0 %/100.0 %) |
ALIGNMENTS |
MODEL[1] Protein A "queryA" TEMPLATE:8uug_A_1 identity=100.0% |
queryA 1567:TIKVFTTVDNINLHTQVVDMSMTYGQQFGPTYLDGADVTKIKPHNSHEGKTFYVLPNDDTLRVEAFEYYHTTDPSFLGRYMSALNHTKKWKYPQVNGLTS:1666 :****************************************************************************************************: 8uug_A_1 7:TIKVFTTVDNINLHTQVVDMSMTYGQQFGPTYLDGADVTKIKPHNSHEGKTFYVLPNDDTLRVEAFEYYHTTDPSFLGRYMSALNHTKKWKYPQVNGLTS: 106 SecStr : EEEEEESSSSS EEEEE TTS HHHHTSSEEETTEE SS SSSSS EEEE SHHHHHHHHHHHS TTHHHHHHHHHHHHTTS EETTEE : ExpBur :eeebebbbbeeeeeeeebeeeeebeeebeebbbebeebeeebbeeebeeeebbbeeeeeebeebbeebbeeeeeebbeebbebbeebeebebeebeebbb: queryA 1667:IKWADNNCYLATALLTLQQIELKFNPPALQDAYYRARAGEAANFCALILAYCNKTVGELGDVRETMSYLFQHANLDSCKRVLNVVCKTCGQQQTTLKGVE:1766 :****************************************************************************************************: 8uug_A_1 107:IKWADNNCYLATALLTLQQIELKFNPPALQDAYYRARAGEAANFCALILAYCNKTVGELGDVRETMSYLFQHANLDSCKRVLNVVCKTCGQQQTTLKGVE: 206 SecStr : SSTHHHHHHHHHHTTS BSSHHHHHHHHHHHHT HHHHHHHHHHTT TT HHHHHHHHHTTB TT EEEEEEEETTTEEEEEEEEGGG: ExpBur :beeeeebbbbbbbbbbbbbbebebebebbbebbeebeeeebbebbbbbbbbbeeeeeeebebeebbeebbeebebeebebbbbeebeeeeeeeeeeebee: Contact : bbb b queryA 1767:AVMYMGTLSYEQFKKGVQIPCTCGKQATKYLVQQESPFVMMSAPPAQYELKHGTFTCASEYTGNYQCGHYKHITSKETLYCIDGALLTKSSEYKGPITDV:1866 :****************************************************************************************************: 8uug_A_1 207:AVMYMGTLSYEQFKKGVQIPCTCGKQATKYLVQQESPFVMMSAPPAQYELKHGTFTCASEYTGNYQCGHYKHITSKETLYCIDGALLTKSSEYKGPITDV: 306 SecStr :GTEEES S HHHHHH EEEE TTSSEEEEEEEEEESSEEEEEEEEEEEEE TTS SEEEEEEEETTEEEEEEEEESSSEEEEETTEEEEES EEEEEEEE: ExpBur :bbbbeebbbbeebbebbeeeeeeeeebeebbbebebebbbbbbeeeeeebeeeebbbbbbbeeeeeeeebebbbbeebbbbbebeeeeeeeebebebbbb: Contact : b bb b bbbb b b queryA 1867:FYKENSYTTTIK:1878 :************: 8uug_A_1 307:FYKENSYTTTIK: 318 SecStr :EEE SEEE : ExpBur :bbebeeeebeee: |