Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKSYKFLKEVLHRLKNIENTLKVLDQSQLNVEDKVEQMGLLEEIRHEIISHNIIKESLAEAGTPSNKKKGDSWQLKLIERMHKSNSAIPIDLVKSLSKVKIECQNLRRLSQSEPSSLEKLKERFADLVKLIRGVVSIKSQQLKCSKYDSLLADYDSDITEKDVKEIFPKLGKFFSDNIDRIIEK-QKKDKITNTQKIATQKQIELGSLCLQQIGVT--------SHHTF--------YHHPIDYDESDFCYGLFLLLRYSGHEIYQR----CLAQNSISSSFTRYIMCETQGLFMERMIGTSREFIEFIQPYIKEKLTIKGKVNAKINSVENLYLIFNKVNLSSPLKKADEFSLLANIMLRTKLEQDIINGTLEVKDLHDAWLEGMEHYKIPVKAKNELDTYFQDEYWVSGTMGYFPIKIIALIIAVQIFSFIKKNHYEFLGAIIKGDFGLLIGWLSQNV--CSAKCGFLDLLKKVTGKGLDVECCSSYLSEKYDLSQ |
3HQ2 Chain:A ((154-495)) | --------------------------------------------------------------------------------------------------------------------------------------------------YDALLDLFEPGVTVKVLDQLFAELKEAIIPLVKQVTASGNKPDTSFITKAFPKEKQKELSLYFLQELGYDFDGGRLDETVHPFATTLNRGDVRVTTRYDEKDFRTAIFGTIHECGHAIYEQNIDEALSGTNLSDGASMGIH-ESQSLFYENFIGRNKHFW---TPYYK-KIQEASPVQFKDISLDDFVRAINESKPSFIRVEADELTYPLHIIIRYEIEKAIFSNEVSVEDLPSLWNQKYQDY-LGITPQTDAEGILQDVHWAGGDFGYFPSYALGYMYAAQLKQKMLEDLPEFDALLERGEFHPIKQWLTEKVHIHGKRKKPLDIIKDATGEELNVRYLIDYLSNKYSNLY |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3HQ2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -205872 for 2600 contacts (-79.2/contact) +
2D Compatibility (PS) -33663 + (NN) -9374 + (LL) 12400
1D Compatibility (HY) -20400 + (ID) 4550
Total energy: -261459.0 ( -100.56 by residue)
QMean score : 0.504
|
|
|