Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQFGAKPLFENVSVKFGNGNRYGLIGANGCGKSTFMKILGNDLEPSAGQVMLEPNVRLGKLRQDQFAYEDFSVIDTVIMGHEELWAVKAERDRIYSLPEMSEADGMAVAELEVQFAEFDGYTAESRAGELLLGLG-----------IPLEQHFGPMSAVAPGWKL-RVLLAQALFSDPDVLLLDEPTNHLDI----NTIRWLEGVLTARNSTMIIISHDRHFLNSVCTHMADLDYGELRLFPGNYDEYMTAAEQARERLLSDNAKKKAQIAELQSFVSRFSANASKAKQATSRARQIDKIQLEEVKPSSRVSPFIRFEQYKKLHRQAVTVENISKGYDGKPLFKGLSLQVEAGERVAIIGPNGIGKTTLLRCLVGDLPVDGGEVKWTDSADV-------------GYFAQDHADDFADDMSLFDWMAQWTQGGEQLVRGTLGRMLFSNDEIKKSVKVISGGEQGRMLFGRLILKRPNVLVMDEPTNHLDMES----IEALNLALDNYPGTLIFVSHDREFVSSLATRIIELGENGVTDFSGSYDDYLRSQGVIV |
3OZX Chain:A ((24-457)) | -----------------NNTILGVLGKNGVGKTTVLKILAGEIIPNFG----DPNSKVGK--------------DEVLK--------RFRGKEIYNYFKELYSNELKIVH-KIQYVEYASKFLKGTVNEILTKIDERGKKDEVKELLNMTNLWNKDANILSGGGLQRLLVAASLLREADVYIFDQPSSYLDVRERMNMAKAIRELL--KNKYVIVVDHDLIVLD----YLTDL----IHIIYGESSVYGRVSKSYAARVGINNFLKGYLPAENMKI---------RPDEIKFMLK---------LKTKMKWTKII-----KKLGDFQLVVDN---------------GEAKEGEIIGILGPNGIGKTTFARILVGEITADEGSV--TPEKQILSYKPQRIFPNYDGTVQQYLENASKDALSTSSWFFE-----EVTKRLNLHRLLESN------VNDLSGGELQKLYIAATLAKEADLYVLDQPSSYLDVEERYIVAKAIKRVTRERKAVTFIIDHDLSIHDYIADRIIVFKGEPEKAGLATSPVTLKTGMNEF |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OZX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -149655 for 3037 contacts (-49.3/contact) +
2D Compatibility (PS) -41829 + (NN) -19436 + (LL) 7276
1D Compatibility (HY) -26800 + (ID) 5550
Total energy: -235994.0 ( -77.71 by residue)
QMean score : 0.339
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