Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIIINDGR---LCLIDFGLAKQLTPEEMEEIK----------------VRKQDDFFDLGETLLFLL-----------YSQYKGKKKKNGTWLEEL--TLTKEVTLLLKRLLGIEEEYQHTASIRED---LNRAIQSVT---------------------------------------------------- |
1TKI Chain:A ((18-338)) | ------------------KELYEKYMIAEDLGRGEFGIVHRCVETSSKKTYMAKFVK----VKGTDQVLVKKEISILNIARHRNILHLHESFESMEELVMIFEFISGLDIFERINTSAFELNEREIVSYVHQVCEALQFLHSHNIGHFDIRPENIIYQTRRSSTIKIIEFGQARQLKPGDNFRLLFTAPEYYAPEVHQHDVVSTATDMWSLGTLVYVLLSGINPFLAETNQQIIENIMNAEYTFDEEAFKEISIEAMDFVDRLLVKERKSRMTASEALQHPWLKQKIERVSTKVIRTLKHRRYYHTLIKKDLNMVVSAARISCGGAIRSQKGVSVAKVKVASI |
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General information:
TITO was launched using:
| RESULT:
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Template: 1TKI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -119985 for 1650 contacts (-72.7/contact) +
2D Compatibility (PS) -24757 + (NN) -7665 + (LL) 1548
1D Compatibility (HY) -13600 + (ID) 3300
Total energy: -167759.0 ( -101.67 by residue)
QMean score : 0.373
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