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 |
4DWQ Chain:A ((26-451)) | ----------GRVYADEVLLEKMKNDRTLEQATNVAMLPGIYKYSI-VMPDGHQGYGFPIGGVAAFDVKEGVISPGGIGYDINCGVRLIRTNLTEKEVRPRIKQLVDTLFKNVPSGVGSQGRIKLHWTQIDDVLVDGAKWAVDNGYGWERDLERLEEGGRMEGADPEAVSQRAKQRGAPQLGSLGSGNHFLEV-QVVDKIFDPEVAKAYGLFEGQVVVMVHTGSRGLGHQVASDYLRIMERAIRKYRIPWP--------------------DRELVSVPFQSE-----EGQRYFSAMKAAANFAWANRQMITHWVRESFQEVFKQDPEGDLGMDIVYDVAHNIGKVEEHEVDGKRVKVIVHRKGATRAFPPGHEAVPRLYRDVGQPVLIPGSMGTASYILAGTEGAMKETFGSTCHGAGRVLSRKAATRQYRGDRIRQELLNRGIYVRAASMRVVAEEAPGAY---------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4DWQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -89729 for 2679 contacts (-33.5/contact) +
2D Compatibility (PS) -35855 + (NN) -9269 + (LL) 4672
1D Compatibility (HY) -19600 + (ID) 5150
Total energy: -154931.0 ( -57.83 by residue)
QMean score : 0.452
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