Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MWKEKVQQYEDQIINDLKGLLAIESVRDDAKASEDAPVGPGPRKALDYMYEIAHRDGFTTHDVD-HIAGRIEAG-K---GNDVLGILCHVDVVPAGD------------------------------GWD-SNPFEPV----VTEDAIIARGTLDDKGPTIAAYYAIKILEDMNVDWKKRIHMIIGTDEESDWKCTDRYFKTEEMPTLGFAPDAEFPCIHGEKGITTFDLVQNKLTEDQDEPDYELITFKSGERYNMVPDHAEARVLVKENMTDVIQDFEYFLEQNHLQGDSTVDSGILVLTVEGKAVHGMDP-SIGVNAGLYLLKFLASLNLDNNAQAFVAFSNRYLFNSDFGEKMGMKFHTDVMGDVTTNIGVITYDNENAGLFGINLRYPEGFEFEKAMDRFANEIQQY----G---FEVKLGKV-QPPH-YVDKNDPFVQKLVTAYRNQTNDMTEPYTIGGGTYARNL-DKGVAFGAMFSDSEDLMHQKNEYITKKQLFNATSIYLEAIYSLCVEE |
3IFE Chain:A ((19-433)) | --YFQSNAMKEELIERFTRYVKIDTQSNED--SHTVPTTPGQIEFGKLLVEELKEVGLTEVTMDDNGYVMATLPANTDKDVPVIGFLAHLDTATDFTGKNVKPQIHENFDGNAITLNEELNIVLTPEQFPELPSYKGHTIITTDGTTLLG---ADDKAGLTEIMVAMNYLIHNPQIKHGKIRVAFTPDEEIGR-GPAHFDVEA------FGASFAY-MMDGG------------------------------------PLG------------GL--------------EYESFNAAGAKLTFNGTNTHPGTAKNKMRNATKLAMEFNGHLPVEEAP----EY--------------------TEGYEGFYHLL-SLNGDVEQSKAYYIIRDFDRKNFEARKNTIENIVKQMQEKYGQDAVVLEMNDQYYNMLEKIEPVREIVDIAYEAMKS-LNIEPNIHPIRGGTDGSQLSYMGLPTPNIFTG-GENYHGKFEYVSVDVMEKAVQVIIEIARRFEEQ- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IFE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -102524 for 3051 contacts (-33.6/contact) +
2D Compatibility (PS) -39420 + (NN) -15832 + (LL) 7476
1D Compatibility (HY) -7200 + (ID) 2850
Total energy: -160350.0 ( -52.56 by residue)
QMean score : 0.392
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