Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIIIND-GRLCLIDFGLAKQLTPE---------E--------MEEIKVRKQDDFFDLGETLLFLLYSQYK--GKK---KK-----NG--TWLEELTLTKEVTLLLKRLLGIEEE-YQHTASIREDLNRAIQSVT |
4FIE Chain:A ((152-401)) | -----------------------YLDNFIKIGEGSTGIVCIATVRSSGKLVAVKKMDLRK---QQRRELLFNEVVIMRDYQHENVVEMYNSYLVGDELWVVMEFLEGGALTDIVT--HTRMNEEQIAAVCLAVLQALSVLHAQGVIHRDIKSDSILLTHDGRVKLSDFGFCAQVSKEVPRRKSLVGTPYWMAPELISRLPYGPEVDIWSLGIMVIEMVDGEPPYFNEPPLKAMKMIRDNLPPRLKNLHKVSPSLKGFLDRLLVRDPAQRATAAELLKH--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4FIE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -131584 for 1591 contacts (-82.7/contact) +
2D Compatibility (PS) -23746 + (NN) -9938 + (LL) 3348
1D Compatibility (HY) -16400 + (ID) 1950
Total energy: -180270.0 ( -113.31 by residue)
QMean score : 0.454
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