Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPQPTSQQRASVASSQSTQGAVGWSAATGWVVLFVAVALVVWFVSLDMRHLVGPDEGRYAEISREMFASGDWVTIRYNALKYFEKPPFHMWVTVVGYELFGLGEWQARLAVALSGLLGIGVSMMAARRWFGARAAAFTGLALLAAPMW--SVAAHFNTLDMTLAGVMSCVLAFMLMGQHPDASVAARRGWMVACWAAMGVAILTKGLVGIALPGLVLVVYTLVTRDWGLWRRLHLALGVV----VMLVITVPWFYLVSVRNPEFPNFFFIHEHWQRYTSNIHSRSGSVFYFLPLVIGGFLP--WAGIFPKLWTAMRAPVEGTQARFRPALMAG--IWAIAIFVFFSISRSKLPGYIVPVIPALGILAGVALDRLSPRSW------GKQLIGMAIVAACGLLASPVVATLNANHIPNSFYRAYA-----------------VWVAVAFVVMLLG---------------IAVARLLLRRGVLPSVAVYAMGMYLGFTVALLGHETVGRPAS---GADIAPQIAQKLTPE---------------MPLYGVQMLDHTLPFY----------------------------LRHPLMMVGQADELTFGATVEPQRVVPDVDSFTKLWKNGQPA--------MAVMSPDTYLALAPTL--SMYVVA--------RDWRRVVVANVASLAGPQ |
3RCE Chain:A ((2-711)) | ELQQNFTDNNSIKYTCILILIAFAFSVLCRLYWVAWASEFYEFFFNDQLMITTNDGYAFAEGARDMIAG----FHQPNDLSYFGSSLSTLTYWLYSILPFSFESIILYMSTFFASLIVVPIILIAREYKLTTYGFIAALLGSIANSYYNRTMSGYYDTDMLVLVLPMLILLTFIRLTINKDIFTLLLSPIFIMIYLWWYPSSYSLNFAMIGLFGLYTLVFHRKEKIFYLAIALMIIALSMLAWQYKLALIVLLFAIFAFKEEKINFYMIWALIFISISILHLSGGAFMYFNVNETIMEVNTIDPEVFMQRISSSVLVFILSFIGFILLCKDHKSMLLALPMLALGFMALRAGLRFTIYAVPVMALGFGYFLYAFFNFLEKKQIKLSLRNKNILLILIAFFSISPALMHIYYYKSSTVFTSYEASILNDLKNKAQREDYVVAWWDYGYPIRYYSDVKTLIDGGKHLGKDNFFSSFVLSKEQIPAANMARLSVEYTEKSFKENYPDVLKAMVKDYNQTSAKDFLESLNDKNFKFDTNKTRDVYIYMPYRMLRIMPVVAQFANTNPDNGEQEKSLFFSQANAIAQDGSVMLDNGVEIINDFRALKVEGASIPLKAFVDIESITNGKFYYNEIDSKAQIYLLFLREYKSFVILDESLYNSAYIQMFLLNQYDQDLFEQVTNDTRAKIYRLK |
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General information:
TITO was launched using:
| RESULT:
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Template: 3RCE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -442348 for 4517 contacts (-97.9/contact) +
2D Compatibility (PS) -58126 + (NN) 146 + (LL) 100
1D Compatibility (HY) -30000 + (ID) 3300
Total energy: -533528.0 ( -118.12 by residue)
QMean score : 0.192
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