Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQGLLTSGRKPSGGGRCTGRGGWRGQWCLKPWMGGADPPTPTLSCLLLPVPPELPDHCYRMNSSPAGTPSPQPSRANGNINLGPSANPNAQPTDFDFLKVIGKGNYGKVLLAKRKSDGAFYAVKVLQKKSILKKKEQSHIMAERSVLLKNVRHPFLVGLRYSFQTPEKLYFVLDYVNGGELFFHLQR-ERRFLEPRARFYAAEVASAIGYLHSLNIIYRDLKPENILLDCQGHVVLTDFGLCKEGVEPEDTTST-FCGTPEYLAPEVLR-----KEPYDRAVDWWCLGAVLYEMLHGLPPFYSQDVSQMYENILHQP--LQIP---GGRTVAACDLLQSLLHKDQRQRLGSKADFLEIKNHVFFSPINWDDLYHKRLTPPFNPNVTGPADLKHFDPEFTQEAVSKSIGCTPDTVASSSGASSAFLGFSYAPEDDDILDC |
4AW2 Chain:A ((71-407)) | -----------------------------------------------------------------------------------------LHREDFEILKVIGRGAFGEVAVVKLKNADKVFAMKILNKWEMLKRAETACFREERDVLVN-GDSKWITTLHYAFQDDNNLYLVMDYYVGGDLLTLLSKFEDRLPEEMARFYLAEMVIAIDSVHQLHYVHRDIKPDNILMDMNGHIRLADFGSCLKLMEDGTVQSSVAVGTPDYISPEILQAMEGGKGRYGPECDWWSLGVCMYEMLYGETPFYAESLVETYGKIMNHKERFQFPTQVTDVSENAKDLIRRLIC-SREHRLGQ-NGIEDFKKHPFFSGIDWDNI--RNCEAPYIPEVSSPTDTSNFDVD--------------------SGHHLPFVGFTYTSSC------ |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4AW2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -195015 for 2488 contacts (-78.4/contact) +
2D Compatibility (PS) -33401 + (NN) -23646 + (LL) 1496
1D Compatibility (HY) -30800 + (ID) 6000
Total energy: -287366.0 ( -115.50 by residue)
QMean score : 0.377
|
|
|