Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIIIND-GRLCLIDFGLAKQLTPE-----------E-------ME--EIKVRKQDDFFDLGETLLFLLYSQYK--GK-K--KKNGTWL-------EELTLTKEVTLLLKRLLGIEEE-YQHTASIREDLNRAIQSVT |
| 3TKI Chain:A ((5-262)) | --------------------FVEDWDLVQTLGEGAYGEVQLAVNRVTEEAVAVKIVDMK---------NIKKEICINKMLNHENVVKFYGHRREGNIQYLFLEYCSGGELFDRIEP-DIGMPEPDAQRFFHQLMAGVVYLHGIGITHRDIKPENLLLDERDNLKISDFGLATVFRYNNRERLLNKMCGTLPYVAPELLKRREFHAEPVDVWSCGIVLTAMLAGELPWDQPSDSCQEYSDWKEKKTYLNPWKKIDSAPLALLHKILVENPSARITIPDIKKD--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3TKI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -133949 for 1600 contacts (-83.7/contact) +
2D Compatibility (PS) -23071 + (NN) -9447 + (LL) 3668
1D Compatibility (HY) -10400 + (ID) 2150
Total energy: -175349.0 ( -109.59 by residue)
QMean score : 0.432
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