Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequence--------------------------------------------MGIPGLEGLHTWISIPFSFMYIVAVAGNIFLIF----LIMTERSLHEPMY------LFLSMLASADFLLATAAAPKVLAILWFHSM---DISFGSCVSQMFF------------IHFIFVAESAILLAMAFDRYVAICYPLRYTILTSSAVRKIGIAAVVRSFFI---CCPFIFLVYRLTYCGRNIIPHSYCEHIA---RLACGNINVNIIYGLTVALLSTG-LDIVLIIISYTM-ILHSVF----------QISSWAARFKALSTCG-------SHICV--------------IFMFYTPAFFS--FLAHRFGGKTIPHHIHILVGSLYVLVPPMLNPIIYGVKTKQIKDRVILLFS----PISVC-
3GRE Chain:A ((1031-1454))ESIEKFLSTFILPPLRDYKEFGPIQEIVRSPNMGNLRGKLIATLMENEPNSITSSAVSPGETPYLITGSDQGVIKIWNLKEIIVGEVYSSSLTYDCSSTVTQITMIPNFDAFAVSSKDGQIIVLKVNHYQQESEVKFLNCECIRKINLKNFGKNEYAVRMRAFVNEEKSLLVALTNLSRVIIFDIR-TLERLQIIENSPRHGAVSSICIDEECCVLILGTTRGIIDIWDIRFNVLIRSWSFGDHAPITHVEVCQFYGKNSVIVVGGSSKTFLTIWNFVKGHCQYAFINSDEQPSMEHFLPIEKGLEELNFCGIRSLNALSTISVSNDKILLTDEATSSIVMFSLNELSSSKAVISPFSDVFIPTQVT---ANLTMLLRKMKHDIINSISTCEVDETPLLVACDNSGLIGIFQ


General information:
TITO was launched using:
RESULT:

Template: 3GRE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -440259 for 2192 contacts (-200.8/contact) +
2D Compatibility (PS) -31802 + (NN) 6342 + (LL) 664
1D Compatibility (HY) -14000 + (ID) 2800
Total energy: -481855.0 ( -219.82 by residue)
QMean score : 0.043

(partial model without unconserved sides chains):
PDB file : Tito_3GRE.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3GRE-query.scw
PDB file : Tito_Scwrl_3GRE.pdb: