Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MVFKDATAMAQAIKQHKVSSQELVEQAIYKIEEQN---VSVNAVVSKQYNEARQAAKYA------NASNAPFAGVPILLKDLGQNQKGQLSTSGSQLFKHYYAKQTDYLVQSFEKLGFIILGRTNTPEFGF-----KNISDSQLHGNVNLPFDHSRNAGGSSGGAAAAVSSGMVPIAGASDGGGSIRIPASFNGLIGLKPSRGRIPVGPSSYRGWQGASSHFALTKSVRDTKRLLYYLQSYQVESPFPLKKLSK---ESLFE---FSVSKPLKIAVLMDSPLKTKVSSEAKAAIKEAADFLSQKGNHLELVEQPLDGIHSMKTYCMMNSVETAAMFDGIEKSLGRSM----------------EFSDMELMTWAMYQSGQRVLAKDYSKLLDSWDQ--FAATMARFHE--NYDLILTAATNQPAPFHGQFDLDETLQKQLRHMREFSVSEQQDLIWKMFEDSMAWTPFTHQPNLTGQPSLAIPTHLTKEGLPLGVQLTAAKGREDLLLAVAELFEKEKQFKGPVCH |
1M22 Chain:A ((9-491)) | -AETDVADLQARMTAGELDSTTLTQAYLQRIAALDRTGPRLRAVIELNPD-ALKEAAERDRERRDGRLRGPLHGIPLLLKDNIN-AAPMATSAGSLALQGFR-PDDAYLVRRLRDAGAVVLGKTNLSEWANFRGNDSISGWSARGGQTRNPYRISHSPCGSSSGSAVAVAANLASVAIGTETDGSIVCPAAINGVVGLKPTVGLVSRDGII-PISFSQDTAGPMARSVADAAAVLTAIAGRDDADPATAT-MPGRAVYDYTARLDPQGLRGKRIGLLQTPL---LKYRGMPPLIEQAATELRRAGAVVVPVELPNQG-AWAEAERTLLLYEFKAGLERYFNTHRAPLRSLADLIAFNQAHSKQELGLFGQELLVEADATAGLADPAYIRARSDARRLAGPEGIDAALAAHQLDALVAPTTGVAWPIRS---D--------------------------F-----PGESYSAAAVAGYPSLTVPMGQI-DGLPVGLLFMGTAWSEPKLIEMAYAYEQRTRARRPPHF |
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General information:
TITO was launched using:
| RESULT:
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Template: 1M22.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -68455 for 4276 contacts (-16.0/contact) +
2D Compatibility (PS) -47799 + (NN) -22104 + (LL) 4256
1D Compatibility (HY) -5200 + (ID) 4400
Total energy: -143702.0 ( -33.61 by residue)
QMean score : 0.442
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