Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRYLDEQAIENIAIGAAFLGTGGGGDPYIGKMMALTAIKKHGPIKLLSPEEIADDDYFIPAAMMGAPSVLIE-KFPKGD-EFVRVFEKLGRYVGKEVKGTFPMEAGGVNSMIPIVVAAQLGLPMVDCDGMGRAFPELQMVTFHLDGISATPMAITDEKG---NIGI-METIDNKWTERLARV---------TTVEMGASSLVSLYPCNGAQIKQS-SIKNIVTLSEEIGKVIRETSMDEAEK----LQKLLDVTHGYHLFEGKITDVVRETRAGFNFGRVKIDGLNKDTNSEVIVHFQNENLVAEKNG--EPIAITPDLICMVDLETLMPVTTEALKYGKRVRVMALPADDAWRTDKGIETVGPRYFGYDVDFEPLEELVKKEERRHV |
2O3I Chain:A ((49-320)) | -------------------------------------------VRVVDVDEATDGD-CVMVAYMGAPDAINQVQWPNGPVEAALAARQRLESQGRKLAYVVAPESGALGFVVASLVAAKLGLAVVDADGAGRAVPSLPMLTYAAAGVPPTPAFLAGESGLCVELGVRMPPPD---REDISTVVEQMLRPILTNPQFGQFGGLAMWMMSPAQLGGALPVRGTLSRALKLGRALQDGKVKTAEAMLDFLRRELDIKGKLLFGPATLASP----------GKVVLE----DGERRCTVLYQNESLLAWDSALSHPLATAPDAI-------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2O3I.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 17094 for 1653 contacts (10.3/contact) +
2D Compatibility (PS) -22017 + (NN) 7105 + (LL) 7920
1D Compatibility (HY) 11200 + (ID) 1100
Total energy: 20202.0 ( 12.22 by residue)
QMean score : 0.044
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