Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLTLKGKYNEAKVFTDNV------DDNTIGQIITLCNQPFAKDSKIRIMPDTHGGKGCVIGTTMTIQDK---IVPNLVGVDIGCGLYVVK--LKPGKLKMDFDKLDKVIRERVPSGS------KTHDKPVDEFDLEGIVAPIH--HGWV----------------------------ARSIGTLGGGNHFIEVNQGSDGIY----------------LVIHSGSRVLGKEIAEYHQEVAYKRLDILRKELKLDATAAKKRGNLEMANNLNGEREQVKLDYDLSYVTGVDLKNYLNDMEIAQKFAARNRYVMAQIILKAMK--------WDKAVVSAFDCVHNYIDIEHNML----------RKGATSA-------------QLGEQIIVPLNMREGS-ILATGKGNADWNY-SAPHGAGRMLSRSKAKAQISLESYQAAM--KDVWTTSVSKKTI-DEAPKAYKSAKQLLADVEDTMEIQEIIKPLYNFKA |
4DWR Chain:B ((26-451)) | ----------GRVYADEVLLEKMKNDRTLEQATNVAMLPGIYKYSI-VMPDGHQGYGFPIGGVAAFDVKEGVISPGGIGYDINCGVRLIRTNLTEKEVRPRIKQLVDTLFKNVPSGVGSQGRIKLHWTQIDDVLVDGAKWAVDNGYGWERDLERLEEGGRMEGADPEAVSQRAKQRGAPQLGSLGSGNHFLEV-QVVDKIFDPEVAKAYGLFEGQVVVMVHTGSRGLGHQVASDYLRIMERAIRKYRIPWP--------------------DRELVSVPFQSE-----EGQRYFSAMKAAANFAWANRQMITHWVRESFQEVFKQDPEGDLGMDIVYDVAHNIGKVEEHEVDGKRVKVIVHRKGATRAFPPGHEAVPRLYRDVGQPVLIPGSMGTASYILAGTEGAMKETFGSTCHGAGRVLSRKAATRQYRGDRIRQELLNRGIYVRAASMRVVAEEAPGAY---------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4DWR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -79831 for 2735 contacts (-29.2/contact) +
2D Compatibility (PS) -35678 + (NN) -9475 + (LL) 4672
1D Compatibility (HY) -19600 + (ID) 5150
Total energy: -145062.0 ( -53.04 by residue)
QMean score : 0.439
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