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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(CATL1_HUMAN) | A 1 (A) | polymer(polypeptide(L)) [219 aa] | CATHEPSIN S :CATS_MOUSE | |
2 | b | I 1 (A) | non-polymer(8PW) | (2S,4R)-N-(1-cyanocyclopropyl)-1-(1-methylcyclopropanecarbonyl)-4-[4-(2,2,2-trifluoroethoxy)-2-(trifluoromethyl)phenyl]sulfonylpyrrolidine-2-carboxamide | 132Q 136G 137S(A) 138C 139W 176E(K) 180G 181G 182L(Y) 183M 248A(G) 274M(V) 275D(N) 276H 277G 327A(Y) (identity: 56.2 %/59.8 %) |
ALIGNMENTS |
MODEL[1] Protein A "queryA" TEMPLATE:4bqv_A_1 identity=59.8% |
queryA 115:PRSVDWREKGYVTPVKNQGQCGSCWAFSATGALEGQMFRKTGRLISLSEQNLVDCSGPQ--GNEGCNGGLMDYAFQYVQDNGGLDSEESYPYEATEESCK: 212 :* ******* ** ** ** ** ****** ****** *** ***** ******* ** ** ** * **** **** **** * * * : 4bqv_A_1 9:PDTVDWREKGCVTEVKYQGSCGACWAFSAVGALEGQLKLKTGKLISLSAQNLVDCSNEEKYGNKGCGGGYMTEAFQYIIDNGGIEADASYPYKAMDEKCH: 108 SecStr : S EEGGGGT B TTSB HHHHHHHHHHHHHHHHHHS B HHHHHHHS STTTT TTB HHHHHHHHHHHT EEBTTTS SS : ExpBur :eeebbbeeeebbbebbebbebebbbbbbbbbbbbbbbeeeeeeeebbbbbbbbbbbeeeebebebbeeeebbebbebbeeeebbbbeeebeeeeeeeeee: Contact : b bbbb b bbbb queryA 213:YNPKYSVANDTGFVDIP-KQEKALMKAVATVGPISVAIDAGHESFLFYKEGIYFEPDCSSEDMDHGVLVVGYGFESTESDNNKYWLVKNSWGEEWGMGGY: 311 :** * * * * ** **** ** ** *** * ** *** * * * * ********* * ********* * **: 4bqv_A_1 109:YNSKNRAATCSRYIQLPFGDEDALKEAVATKGPVSVGIDASHSSFFFYKSGVYDDPSCTG-NVNHGVLVVGYG----TLDGKDYWLVKNSWGLNFGDQGY: 203 SecStr : GGGEEE EEEE TT HHHHHHHHHHT EEEEE STHHHH SS B TT S- EEEEEEEEE----EETTEEEEEEE SB TTSTBTTE: ExpBur :beeeeeebebeeeeebeeeebebbeebbbeebbbbbbbbbeeeebeebeeebbebeebee-eeeebbbbbbbb----eeeeeebbbbbbbebeebbeebb: Contact : b bbbb queryA 312:VKMAKDRRNHCGIASAASYPTV: 333 : ** ******* *** : 4bqv_A_1 204:IRMARNNKNHCGIASYCSYPEI: 225 SecStr :EEEE SSSSGGGTTTS EEEE : ExpBur :bbbbbeeebbbbbbbebbbbbe: Contact : b |