Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTESKFPKDFLWGGAVAANQCEGAYLEDGKGLSLVDILPTVEDGRWEALFNPSKALATDYGFYPSHESIDFYHRYKEDIKLMAEMGFKCFRMSISWPRIFPNGDETTPNEKGLAFYDAVFDECHKYGIEPVVTINHFDTPLEVFKKYGGWKNRKCIDFYLNFCEAIFTRYKDKVKYWMTFNEINMILHLPYIGGGLDVTKEDNPEEVKY------QAAHHQLVASALATKLGHEINPENQIGCMLAAGNTYPMTC-NPKDVWKS-IEADREGYFFIDVQARGYYPSYT----KRFFKEHNINIKMEDGD---LDALRDHTVDYVAFSYYSSRLTSA-------------DPEKNKETEGNVFATLKNPYLKASEWGWQIDPLGLRITMNTIYDRYQ--KPLFIVENGLGAVDTVEEDGSITDDYRIDYMREHVREMGEAIEDGVELLGYTPWGCIDLVSAGSGEMKKRYGFIYVDRDNKGNGTLNRSKKKSFDWYKKVIETNGKDID |
4PBG Chain:A ((1-465)) | MTKT-LPKDFIFGGATAAYQAEGATHTDGKGPVAWD--KYLEDNYW----------------YTAEPASDFYHKYPVDLELAEEYGVNGIRISIAWSRIFPTGYGEV-NEKGVEFYHKLFAECHKRHVEPFVTLHHFDTP-EALHSNGDFLNRENIEHFIDYAAFCFEEFPE-VNYWTTFNEIGPIGDGQYLVGKF-------PPGIKYDLAKVFQSHHNMMVSHARAVKLYKDKGYKGEIGVVHALPTKYPYDPENPADVRAAELEDIIHNKFILDATYLGHYSDKTMEGVNHILAENGGELDLRDEDFQALDAAKDLN-DFLGINYYMSDWMQAFDGETEIIHNGKGEKGSSKYQIKGVGRRVAPDYVPRTDWDWIIYPEGLYDQIMRVKNDYPNYKKIYITCNGLGYKDEF-VDNTVYDDGRIDYVKQHLEVLSDAIADGANVKGYFIWSLMDVFSWSNG-YEKRYGLFYVDFD-----TQERYPKKSAHWYKKLAETQ----- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4PBG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -178472 for 3761 contacts (-47.5/contact) +
2D Compatibility (PS) -45903 + (NN) -17309 + (LL) 1492
1D Compatibility (HY) -30000 + (ID) 8500
Total energy: -278692.0 ( -74.10 by residue)
QMean score : 0.536
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