Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIIIND----GRLCLIDFGLAKQLTPE---------E--------MEEIKVRKQDDFFDLGETLLFLLYSQYK--GKKK---------KNGTWLE--ELTLTKEVTLLLKRLLGIEEE-YQHTASIREDLNRAIQSVT |
3SOA Chain:A ((8-268)) | -------------------RFTEEYQLFEELGKG--SVVRRCVKVLAGQEYAAMIINTKKL-SARDHQKLEREARICRLLKHPNIVRLHDSISEEGHHYLIFDLVTGGELFEDIV-AREYYSEADASHCIQQILEAVLHCHQMGVVHRNLKPENLLLASKLKGAAVKLADFGLAIEVEGEQQAWFGFAGTPGYLSPEVLRKDPYGKPVDLWACGVILYILLVGYPPFWDEDQHRLYQQIKAGAYDFPSPEWDTVTPEAKDLINKMLTINPSKRITAAEALKH--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3SOA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -119447 for 1592 contacts (-75.0/contact) +
2D Compatibility (PS) -23926 + (NN) -9477 + (LL) 2616
1D Compatibility (HY) -13600 + (ID) 2450
Total energy: -166284.0 ( -104.45 by residue)
QMean score : 0.480
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