Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MRIVQPVIEQLKAQSHPVCHYIYDLVGLEHHLQHITSSLPSNCQMYYAMKANSERTILDTISQYVEGFEVASQGEI--AKGLAFKPANHIIFGGPGKTDEELRYAVSEGVQRIHVESMHELQRLNAILEDEDKTQHILLRVNLAGPFPNATLHMAGRPTQFGISEDEVDDVIEAALVMPNIHLDGFHFHSISNNLDSNLHVDVVKLYFKKAKSWSEKHRFPLKHINLGGGIGVNY-------ADLTSQFEWDNFVENFKTLIVEQEMEDVTLNFECGRFIVAHIGYYVTEVLDIKKVHGAWYAILRGGTQQFRLPV---SWQHNHPFEIYRYKDNPYSFEKVSISRQDTTLVGQLCTPKDVFAREVQIDAISTGDVIVFKYAGAYGWSISHHDFLSHPHPEFIYLTQTKEDE |
| 2P3E Chain:A ((29-384)) | ------------AQTFGTPLYVYSSNFIKERFEAYRKAFP-DALICYAVKANFNPHLVKLLGELGAGADIVSGGELYLAKKAGI-PPERIVYAGVGKTEKELTDAVDSEILMFNVESRQELDVLNEIAGKLGKKARIAIRVNP---------------SKFGVDIREAQKEYEYASKLENLEIVGIHCHIGSQILDISPYREAVEKVVSLYESLTQKG-FDIKYLDIGGGLGIKYKPEDKEPAPQDLADLLKDLL--VKAKII----------LEPGRSIMGNAGILITQVQFLKDKGSKHFIIVDAGMNDLIRPSIYNAYHHIIPVETKE---------------VVADIVGPICETGDFLALDREIEEVQRGEYLAVLSAGAYGFAMSSH-------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2P3E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -217227 for 2715 contacts (-80.0/contact) +
2D Compatibility (PS) -33906 + (NN) -8120 + (LL) 4712
1D Compatibility (HY) -19200 + (ID) 4550
Total energy: -278291.0 ( -102.50 by residue)
QMean score : 0.467
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