Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | --------MRLSQYYLPTLKEKPAHARIISHQYSLRAGLIKQIASGIYTWLPLGLRVLKNIEGIIRDEMNKSGAIEALMP-CVQPASLWRESGRYDDYGKTMLRIRD----RHEEDMLFGPTHEEVATDLIRDIVKSYKNLPLCLYQIQWKFRDEVRPRYGVMRGREFLMKDAYSFNVNYESALNSYNLMYKTYIKIFKRMGLIP--IGVR-ADTGLIGGNLSHEFHILASTGESTLYYDNKFFELLESEDVKSLKSIYAVADDIHDPKTCPVPQEQLNVSKGIEIGHIFYFGDKYSKPMNAKVTAQDGKNVNIHMGSYGIGVSRLVGAIIEAFHDDKGITWPEAVAPFRVGLINL-------QTKTAEYVEIANKIYSTLKSD---EVLYDDTEG-SIGVKFAKMDLIGLPWQIIVGKKAVSENIIEIKNRATGKVE--EVQIEEAINYFNVK-------------------------------------------------------------------------------------------------------- |
3IAL Chain:A ((14-518)) | TFSLTKTRDTFADWFDAIMDA----AELVDRRYPVK---------GCVVFRPYGFFMENAIMRLCEEEYAKVGISQILFPTVIPESFLKKESDHIKGFEAECFWVEKGGLQPLEERLALRPTSETAIYSMFSKWVRSYKDLPLKIHQTCTIFRHETKNTKPLIRVREIHWNEAHCCHATAEDAVSQLSDYWKVIDTIFSDELCFKGQKLRRVCWDRFPGADYSEVSDVVMPCG------------------------------------------------RVLQTAGIHNLGQRFSSTFDILYANKANESVHPYLTCAGIS-TRVLACALSIHGDSGGLVLPPLIAPIHVVIIPIGCGKKNNQESDQQVLGKVNEIADTLKSKLGLRVSIDDDFSKSMGDKLYYYELKGVPLRIEVGQRDLANGQCIVVPRDVGKDQKRVIPITEVMKVSVVKNVIKDELDAYKARLKEKAFAFHNSMVTNCKSFDEIVACIENKGGLARFPFYTTEADGEVWDKKLKDACSAEIRGHNPDENVLPGEVCALSGKPAVCYMYCAKSY |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IAL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -206853 for 2878 contacts (-71.9/contact) +
2D Compatibility (PS) -38293 + (NN) -3911 + (LL) 4164
1D Compatibility (HY) -23200 + (ID) 4150
Total energy: -272243.0 ( -94.59 by residue)
QMean score : 0.467
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