Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLGLNGTPFQPATLQLTGIPGIQTGLTWVALIFCILYMISIVGNLSILTLVFWEPALHQPMYYFLSMLALNDLGVSFSTLPTVISTFCFNYNHVAFNACLVQMFFIHTFSFMESGILLAMSLDRFVAICYPLRYVTVLTHNRILAMGLGILTKSFTTLFPFPFV-----VKRLPFCKGNVLHHSYCLHPDLMKVACGDIHVNNIYGLLVIIFTYG-----MDSTFILLSYALILRAMLVIISQEQRLKALNTCMSHICAVLAFYVPIIAVSMIHRFWKSAPPVVHVMMSNVYLFVPPMLNPIIYSV--KTKEIRKGILKFFHKSQA |
4CRU Chain:B ((4-273)) | MLEREKIYQWINELS----------------------------SPETRENALLELSKKRESVPDLAPMLWHSFGTIAALLQEIVNIYPS----------------------INPPTLTAHQSNRVCNALALLQCVASHPETRSAFLAAH------IPLFLYPFLHTVSKTRPFEYLRLTSLGVIGALVKTDEQEVINFLLTTEIIPLCLRIMESGSELSKTVATFILQKILLDDTGLAYICQTYERFSHVAMILGKMVLQLSKEPSARLLKHVVRCYLRLSDNPRAREALRQCLPDQLKDTTFAQVLKDDTTTKRWLAQLVKNLQE |
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General information:
TITO was launched using:
| RESULT:
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Template: 4CRU.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -247770 for 2012 contacts (-123.1/contact) +
2D Compatibility (PS) -26209 + (NN) -5267 + (LL) 5180
1D Compatibility (HY) -3200 + (ID) 1700
Total energy: -278966.0 ( -138.65 by residue)
QMean score : 0.170
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