Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | DM------SPSQCKEEQRLLVNA----CRAVIFGRSPSP--SCCERVRVTHVECVC-------PVITPQLAALIGVERT-IKQIEGCGRTVP----HNFKCGSITT-P-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
1S3I Chain:A ((1-307)) | -MKIAVIGQSLFGQEVYCQLRKEGHEVVGVFTIPDKDGKADPDGLEAEKDGVPVFKFPRWRARGQALPEVVAKYQALGAELNVLPFCSQFIPMEVINAPRHGSIIYHPSLLPRHRGASAINWTLIHGDKKGGFTIFWADDGLDTGDLLLQKECEVLPDDTVSTLYNRFLFPEGIKGMVQAVRLIAEGTAPRCPQSEEGATYEGIQKKETAKINWDQPAEAIHNWIRGNDKVPGAWTEACGQKLTFFNSTLNTSGLSTQGEALPIPGAHRPGVVTKAGLILFGNDDRMLLVKNIQLEDGKMMPASQFFK |
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General information:
TITO was launched using:
| RESULT:
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Template: 1S3I.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -24029 for 471 contacts (-51.0/contact) +
2D Compatibility (PS) -9123 + (NN) -6594 + (LL) -76
1D Compatibility (HY) 0 + (ID) 600
Total energy: -40422.0 ( -85.82 by residue)
QMean score : 0.339
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