Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLTLKGKYNEAKVFTDNVDDNTIGQIITLCNQPFAKDSKIRIMPDTHGGKGCVIGTTMTIQDKIVPNLVGVDIGCGLYVVKLKPGKLKMDFDKLDKVIRERVPSGSKTHDKPVDEFDLEGIVAPIHHGWVARSIGTLGGGNHFIEVNQGSDGIYLVIHSGSRVLGKEIAEYHQEVAYKRLDILRKELKLDATAAKKRGNLEMANNLNGEREQVKLDYDLSYVTGVDLKNYLNDMEIAQ----KFAAR-NRYVMAQIILKAMKWDKAVVSAFDCVHNYIDI---------EHNMLRKGATSAQLGEQIIVPLNMREGSILATGKGNADWNYSAPHGAGRMLSRSKAKAQIS--LESYQAAMKDVWTTSVSKKTIDEAPKAYKSAKQLLADVEDTMEIQEI-IKPLYNFKA |
3GW4 Chain:A ((8-199)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DYALAERQAQALLAHPATASGARFMLGYVYAFMDRFDEARASFQALQQQAQKSGDHTAEHRALHQVGMVERMAGNWDAARRCFLEERELLASL-PEDPLAASANAYEVATVALHFGDLAGARQEYEKSLVYAQQADDQVAIACAFRGLGDLAQQEKNLLEAQQHWLRARDIFAELEDSEAVNELMTRLNGLEH- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3GW4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 20311 for 1194 contacts (17.0/contact) +
2D Compatibility (PS) -17031 + (NN) -971 + (LL) 12692
1D Compatibility (HY) 12800 + (ID) 700
Total energy: 27101.0 ( 22.70 by residue)
QMean score : 0.136
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