Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------------------------------------------MTETRTEKKKKTTSTFTKVMKIASVAL-----------LGIIFFSITGLAAKYYI---TVQNTFSKINVPL---ESSNKTLSDLEKKKPFSVLLMGSDARAGEKNGRADTIILATANK-QQNAVEMVSIPRDTKVDYGNGDIGKINASYSNGGPSGTVSAVEKLMPGVPVDYFISINMEGFKDLVDAVGGITVYNDIDLTEVNSKFVKGNITLNGTEALQYVRIRHEDPRGDFGRQ------------------DRQRDVIIGIANK-------VISSSGVSNFESIMKAVGDNFQTNMTLTDITSMAANYSSVLKNVDSQELKGEGEMIYSESYGFDLYYFA---PDKTDLERIITMFKKS------LDITE |
2IUT Chain:A ((70-477)) | LPPLSLLDPAEVKQKSYSPESLEAMSRLLEIKLKEFGVEVSVDSVHPGPVITRFEIQPAAGVKVSRISNLAKDLARSLAVISVRVVEVIPGKTTVGIEIPNEDRQMVRFSEVLSSPEYDEHKSTVPLALGHDIGGRPIITDLAKMPH--LLVAGTT-GSG-KSVGVNAMLLSILFKSTPSEARLIMI-----------DPKMLELSIYEGIPHLLCPVVTDMKEAANALRWSVAEMERRYRLMAAMGVR------NLAGFNRKVKDAEEAGTPLTDPLFRRESPDDEPPQLSTLPTIVVVVDEFADMMMIVGKKVEELIARIAQKARAAGIHLILATQRPSVDVITGLIKANIPTRIAFQ--VSSKIDSRTILDQGGAEQLLGHGDMLYLPPGTGLPIRVHGAFVSDDEVHRVVEAWKLRGAPDYIEDILA |
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General information:
TITO was launched using:
| RESULT:
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Template: 2IUT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -39308 for 2141 contacts (-18.4/contact) +
2D Compatibility (PS) -30343 + (NN) 2228 + (LL) 648
1D Compatibility (HY) -10800 + (ID) 2450
Total energy: -80025.0 ( -37.38 by residue)
QMean score : 0.215
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