Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MANTYDLISQRIEAQRQKLI-AIDIVAVASSLGLNLKQGSGGHL-----YWDEHDSFHIYPQTNTFRWWSRSMGTNTIDLVQVIQEELTGKKPSFRETVNFLETGQFESVTVTP--VVREPFKHY--LAP-YE--HHNFDLGRQYLKEERGLSDETIDFALASGSM--------------------------SSATLKKGDYFEPVIIFKSFAEDGRMIGGSLQGIVEN-KVQHPERGRLKQIMKHSDGLAGFHLDV---GTPKRLVFSEAPIDLLSYYELHKESLQNVRLVAMDGVKKGVISRYTADLLTDGQYSQTMPRESIRGAIDAINQTTRILKNNPNMITIAVDNDEAGRNFIKELQE----DGIPINVDLPPRKEHQSKMDWNNYLKQKKGLLKMPQTEGTQKAPEQVLEHEKMDRSQISSGSLEDDPQGSAKPVSKRDTFEQAVTSHPTFSYPLLQFSTEEAFVSNVRDGYHIASEEDIRNLNYYAPSLQQTANWYRDNLADRQVTYMLKGDKEIKALQVSFAKDKFAHLTGIRPIGKGLSAEKLLDDFAKGRGSYPNLTLSNGFNDKIQVLPMIQELSQSKSFVFTDLEEVQKMRNLKASHAIQSNNRSLVVALKTIDDVTFPSSLLRGKKNLNDDLIQKAKENEVLGVLSEKDGNITVLSVNDKYIQDGGQALKDMIKNGELEPLQMETIQRHVPHENAYPKDSDGDGLTDDEEIALGTNPFSSDSDGDGTPDNVEKANGTDPTNASDNEVTRQQEANKRDFTLSEMIKAKNTAALNQHLQDGIKQYFDSDTYKQYLEGMAHFNNYSPRNIQLIMSQFPEASMVASFQEWRKRNGSVKKGEKAIYIQAPVSVMKKDENGKPILNPETGEKETITYFKPVPVFDIKQVSPQEGKELNLPKAMGTIPEQLDKEYYQNVYRSLRDISQNNNKVPIRFRELGQEDGFYSPQTNEIVIKKGMSYERTLSTLIHEMAHSELHNKQSLTERFDGKLTRSTKELQAESIAYVVSSHLGFDTSQESFPYLASWSKEKDGLANLTAQLEIVQEEAKNLMERIDQQLSQYQTVTLNKETQQLTKQEMKKQTHPFYQSLAAAKTSRAQVTTQEKEASVKKDNRPTMP |
2AU3 Chain:A ((3-338)) | -----------MSSDIDELRREIDIVDVISEY-LNLEKVGSNYRTNCPFHPDDTPSFYVSPSKQIFKCFGCGVGGDAIKFVSLYE------DISYFEAALELAKRYGKKLDLEKISKDEKVYVALDRVCDFYRESLLKNREASEYVK-SRGIDPKVARKFD-LGYAPSSEALVKVLKENDLLEAYLETKNLLSPTKGVYRDLFLRRVVIPIKDPRGRVIGFGGRRIVEDKSPKYINSPD-SRVFKKGENLFGLYEAKEYIKEEGFAILVEGYFDLLRLFSEGI---R--NVVAPLGTA---LTQNQANL------------------LS----------KFTKKVYILYDGDDAGRKAMKSAIPLLLSAGVEVYPVYLP-----EGYDPDEFIKEFGKEELRRLINSSGELFETLIKTARENLEEKTREFRYYLGFISDGVRRFALASEFHTKYKVPMEILLMKI------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 2AU3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -84760 for 2204 contacts (-38.5/contact) +
2D Compatibility (PS) -30490 + (NN) -9482 + (LL) 42272
1D Compatibility (HY) -13200 + (ID) 3000
Total energy: -98660.0 ( -44.76 by residue)
QMean score : 0.430
|
|
|