Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNQQLIEALKSKEDKMIEIRRYLHQHPELSFHEDETAKYIAEFYKGKDVEVET-NV------GPRGIKVTIDSGK-PGKTLAIRADFDALPITEDTGLSFASQNKGVMHACGH-------DAHTAYMLVLAETLAEMKDSFTGKVVVIHQPAEEVPPGGAKAMIENGVLDGVDHVLGVHVMSTMKTGNVYYRPGYVQTGRAFFKLKVQGKGGHGSSPHMANDAIVAGSYFVTALQTVVSRRLSPFETGVVTIGSFDGKG-QFNVIKDVVEIEGDVRGLTDATKATIEKEIKRLSKGLEDMYGVTCTLEYNDDYPALY--NDPEFTEYVAKTLKEANLDFGVE-MCEPQPPSEDFAYYAK-ERPSAFIYTGAAVEDGEIYPHHHPKFNISEKSLLISAEAVGTVVLDYLKGDN |
3RZA Chain:A ((19-394)) | --------GMINEQRLLNTFLELVQIDSETGNESTIQPILKEKFIALGLDVKEDEAAKHPKLGANNLVCTMNSTIE-VPKLYLTSHMDTVVPAI-NVKPIVKD-DGYIYSDGTTILGADDKAGLAAMLEVLQVIKEQQI-PHGQIQFVITVGEESGLIGAKELNSEL-L-DADFGYAIDASA--DVGTTVVG----APTQMLISAKIIGKTAHASTPKEGVSAINIAAKAISRMKLGQV-----DEITTANIGKFHG-GSATNIVADEVILEAEARSHDPERIKTQVKHMTDVFETTASELGGKAEVTVEQSYPGFKINDNEAVVKIAQESARN----LGLSANTIISGGGSDGSIINTFGIPSVIL--GVGY-----EKIHTTNERMPIKSLNLLASQVLEIIKIVARQ-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3RZA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -107451 for 3038 contacts (-35.4/contact) +
2D Compatibility (PS) -37581 + (NN) -16132 + (LL) 1608
1D Compatibility (HY) -5600 + (ID) 3100
Total energy: -168256.0 ( -55.38 by residue)
QMean score : 0.458
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