Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MWIKNKVFNRRAFILGGIQLTISTIFSCRLYSLQIRNRQKYEKLADNNRIRVAAIMPKRGRILDRNGIELAVDKISYIVLFDKQKISSEEVDWETLSEIESNVTKSSETKITALYKRHYPFGSICSHTLGYTKKQQGINEAGISGIEYTYDHILKGKPGRSEQEINSKKRIVRELS---SIPQQDGQDVQLTIDIDLQEKIAEIFK-------GHKGSVTAIDVGNGEILTLYNSPSYDNNLFANKLSNEAWEGLNTPSLPLVNRALSYQIPPGSIFKIIVALAGLKDGIITPEEKFSCVGYMKIGERRFCCLKSKVHGYVSLNEAMALSCNTYFYNIGKKISVDSLVEMARKFGIGSGPLIGAFKEEAPGLLPDKDWRTRKLYSEWYLGDTVNLVIGQGYVLTTPLQLAVLAARIAT-GKEVIPRIEMSKTMQDFPDI-DI-AHEHLSIVRKAMFNMVNIKAGTYRKGLS-SIRIAGKTGTPEINSKGESHKLFIAYGPYHDPRYAISVFIEYGK-----APRQDVAMANEILRYMLKG |
3EQU Chain:A ((24-523)) | ----------------------------------------------NRIVRTQALPATRGTVSDRNGAVLALSAPTE-------------------------------------LKRHYPMGNLFAHVIGFTDI----DGKGQEGLELSLEDSLYGEDGAEVVLRDRQGNIVDSLDSPRNKAPQNGKDIILSLDQRIQTLAYEELNKAVEYHQAKAGTVVVLDARTGEILALANTPAYDPNRPGRAD-----------SEQRRNRAVTDMIEPGSAIKPFVIAKALDAGKTDLNERLNTQP-YKIGPSPVRDT--HVYPSLDVRGIMQKSSNVGTSKLSARFGAEEMYDFYHELGIGVRMHS-GFPGETAGLLRNW--------RRWRPIEQATMSFGYG-LQLSLLQLARAYTALTHDGVLLPLSFEKQAVAP---QGKRIFKESTAREVRNLMVSVTEP-GGTGTAGAVDGFDVGAKTGTA------KHVATFIGFAPAKNPRVIVAVTIDEPTAHGYYGGVVAGPPFKKIMGGSLNI |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EQU.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -194831 for 3580 contacts (-54.4/contact) +
2D Compatibility (PS) -42059 + (NN) -14198 + (LL) 8616
1D Compatibility (HY) -5600 + (ID) 5300
Total energy: -253372.0 ( -70.77 by residue)
QMean score : 0.474
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