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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)) [221 aa] | Cathepsin S :CATS_HUMAN | |
2 | b | C 1 (A) | non-polymer(B9S) | (2S)-1-(4,4-dimethylpiperidin-1-yl)-3-{3-[3-({[(4-fluorophenyl)methyl]amino}methyl)-4-(trifluoromethyl)phenyl]-5-(methylsulfonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}propan-2-ol | 139W 174G 176E(K) 179N 180G 181G 182L(F) 183M 247V 248A(G) 273D(N) 274M(V) 275D(N) 276H 277G 327A(F) (identity: 56.2 %/57.0 %) |
ALIGNMENTS |
MODEL[1] Protein A "queryA" TEMPLATE:5qc1_A_1 identity=57.0% |
queryA 115:PRSVDWREKGYVTPVKNQGQCGSCWAFSATGALEGQMFRKTGRLISLSEQNLVDCSGPQ-GNEGCNGGLMDYAFQYVQDNGGLDSEESYPYEATEESCKY: 213 :* ******** ** ** ** ** ***** **** * *** * *** ******* ** ***** * **** ** * ** **** * * *: 5qc1_A_1 3:PDSVDWREKGCVTEVKYQGSCGASWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQY: 102 SecStr : S EEGGGGT B TTSB HHHHHHHHHHHHHHHHHHS B HHHHHHHS GGGT TTB HHHHHHHHHHHT EEBTTTS SS : ExpBur :eeebbbeeeebbbebeebeebebbbbbbbbbbbbbbbeeeeeeeeebbbbbbbbbbeeebebebbeeeebbebbebbeeeebbbbbeebebeeeeeeeee: Contact : b b b bbbbb queryA 214:NPKYSVANDTGFVDIP-KQEKALMKAVATVGPISVAIDAGHESFLFYKEGIYFEPDCSSEDMDHGVLVVGYGFESTESDNNKYWLVKNSWGEEWGMGGYV: 312 : ** * * * * *** ** ** ** * ** * * * ** * ********* ********* * ** : 5qc1_A_1 103:DSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSC-TQNVNHGVLVVGYG----DLNGKEYWLVKNSWGHNFGEEGYI: 197 SecStr : GGGEEE EEEE TT HHHHHHHHHHT EEEEE SHHHHT SSEE TT - S EEEEEEEEE----EETTEEEEEEE SB TTSTBTTEE: ExpBur :eeeeeebebeeeeebeeeebeebeebbbeebbbbbbbbbebeebeebeeeebebeeb-eeeeebbbbbbbbb----eeeeeebbbbbbbbbeebbbebbb: Contact : bb bbbbb queryA 313:KMAKDRRNHCGIASAASYPTV: 333 : ** ******* *** : 5qc1_A_1 198:RMARNKGNHCGIASFPSYPEI: 218 SecStr :EEE SSSSGGGTTTS EEEE : ExpBur :bbbbeeebbbbbbbebbbbbb: Contact : b |