Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MRALLAQNRLVTLCGTGGVGKTRLAIQIASASELRDGLCFVDLAPITESGIVAATAARAVGLPDQPGRSTMDSLRRFIGNRRMLMVLDNCEHLLDACAALVVELLGACPELTILATSREPIGMAGEITWRVPSMSI-TDEAVELFADRASRVQPGFTIANHNAAAVGEICRRLDGIPLAIEFAAARVRSMSPLEIADGLDDCFRLLAGGVRGAVQRQQTLRASIDWSHALLTETEQILFRRLAPFVGGFDLAAVRAVAAGSDLDPFSVLDQLTLLVDKSLVVADDCQGRTRYRLLETVRRYALEKLGDSGEADVHARHRDYYTALAASLNTPADNDHQRLVARAETEIDNLRAAF-AWSRENGHITEALQLASSLQPIWFGRAHLREGLSWFNSILEDQRFHRLAVSTAVRARALADKAMLSTWLATSPVGATDIIAPAQQALAMAREVGDPAALVRALTACGCSSGYNAEAAAPYFAEATDLARAIDDKWTLCQILYWRGVGTCISGDPNALRAAAEECRDLADTIGDRFVSRHCSLWLSLAQMWA--GNLTEALELSREITAEAEASNDVPTKVLGLYTQAQVLAYCGASAAHAIAGACIAAATELGGVYQGIGYAAMTYAALAAGDVTAALEASDAARPILRAQPDQVTMHQVLMAQLALAGGDAIAARQFANDAVDATNGWHRMVALTIRARVATARGEPELARDDAHAALACGAELHIYQGMPDAMELLAGLAGEVGSHSEGVRLLGAAAALRQQTRQVRFKIWDAGYQASVTALREAMGDEDFDRAWAEGAALSTDEAIAYAQRGRGERKRPARGWGSLTPTERDVVRLVSEGLSNKDIAKRLFVSPRTVQTHLTHVYAKLGLPSRVQLVDEAARRGSPS------- |
| 4UI9 Chain:O ((27-756)) | ---------------KDWVTPYKIAVLVLLSEMSRTG----------------------------EGAVSLVERRRL--NQQLLPLLQGPDITVSKLLKLIEES---CPQ------------LANSVQIRIKLMAEGELKDMEQFFDDLSDSFSGTEPEVHKTSVVGLFLRHMILAYSKLSFSQVF-KLYTALQQYFQSDENKKPLSQKQAEFFLSQQASLLKNDETKAL---------------------------------TPASLQKELNNLLKFN-------PDFAEAHYLSYLNNLRVQDVFSSTHSLLHYFDRLILTG--AESKSNGEEGYGRSLRYAALNLAALHCRFGHYQQAELALQEAIRIAQESN----DHVCLQHCLSWLYVLGQKRSDSYVLLEHSVKKAVHFGLPYLASLGIQSLVQQRAFAGKTANKLMDALKDSDLLHWKHSL----------SELIDISIAQKTAIWRLY--------------------GRSTMALQQAQMLLSMNSLEQQNNTESFAVALCHLAELHAEQGCFAAASEVLKHLKERFP-PNSQHAQLWMLCDQKIQFDRAMNDGKYHLADSLVTGITALNS-----------------------IEGVYRKAVVLQAQNQMSEAHKLLQKLLVHCQKL--------KNTEMVISVLLSVAELYWRS------SSPTIALPMLLQALALSKEYRL-QYLASETVLNLAFAQLI---------LGIPEQALSLLHMAIEPILADG--------------AILDKGRAMFLVAKCQVASAASYDQPKKAEALEAAIENLNEAKNYFAKVD---------CKERIRDVVYFQARLYHTLGKTQERNRCAMLFRQLHQELPSVPLINHL |
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General information:
TITO was launched using:
| RESULT:
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Template: 4UI9.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -100681 for 5327 contacts (-18.9/contact) +
2D Compatibility (PS) -73485 + (NN) -29889 + (LL) 16060
1D Compatibility (HY) -20800 + (ID) 5850
Total energy: -214645.0 ( -40.29 by residue)
QMean score : 0.251
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