Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MEKSVNVIGAGLAGSEAVWQLVNRGVKVDLYEMRPVKQTPAHHTDKFAELVCTNSLRANGLTNAVGVIKEEMRMLD----------SIIIEAA---DKASVPAGGALAVDRHEFSGYITDKVKNHPLVTVHTE------------------EVTTIPEGPTIIATGPLTSP---------------------ALADEIKQLTGEEYLYFYDAAAPIIEKDSIDMDKVYLKSRYDKG-EAAYLNCPMS-EEEFNAFYEALVTAETAAL--KEFEKEVFFEGCMPIEVMAKRGIKTMLFGPLKPVGLEDPKTGKRPYAVLQLRQDDAAGTLYNMVGFQTHLKWGEQKRVFGMIPGLENAEIVRYGVMHRNTFINSPTVLEPTYQLKTRNDLFFAGQMTGVEGYVESAASGLAAGINAANFIQEKELVVF-PTETAIGSLAHYITSAS-----------------------KKSFQPMNVNFGLFPELET-KIRAKQERNEKLAERALNAIKKVAEEL |
3CP8 Chain:A ((20-487)) | HMYDVIVVGAGHAGCEAALAVARGGLHCLLITSDLSA---------VARMSCNPAIGGVA----KGQITREIDALGGEMGKAIDATGIQFRMLNRSKGPAM-HSPRAQADKTQYSLYMRRIVEHEPNIDLLQDTVIGVSANSGKFSSVTVRSGRAIQAKAAILACGTFLNGLIHIGMDHFPGGRSTAEPPVEGLTESLAS-LGFSFGRLKTGTPPRIDSRSVDYTIVTEQPGDVDPVPFSFSSTSVANRNL-VSCYLTKTTEKTHDILRTGFDRSPLFTGCPSIED------KISRF-------------PDKSSHHIFLEPEGTDTVEMYVNGFSTSLPEDIQIAGLRSIPGLEEAKMIRPGYAIEYDFFH-PWQIRSTMETRPVENLFFAGQINGTSGYEEAAAQGLMAGINAVRKILGKELIVLGRDQAYIGVLIDDLITKETKEPYRMFTSSAEHRLILRHDNADLRLRKIGYDCNLVSSDDLHRTESIIK-------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3CP8.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -142532 for 3192 contacts (-44.7/contact) +
2D Compatibility (PS) -40095 + (NN) -11923 + (LL) 3420
1D Compatibility (HY) -14800 + (ID) 4500
Total energy: -210430.0 ( -65.92 by residue)
QMean score : 0.396
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