Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MIELKNVYRTFKNGDKNIRVLKDINIHINAGEFIAIMGPSGSGKSTLINILGFIDREYHGEYLFEGSNYQTQSDNQLANIRNKTVGFVFQNFKLIHNNTILENISMPLVYTNMNTIERKNKVMTVLSAVGLDGKGDFTP--------------SKLSGGQQQRVAIARAIINNPKFIIADEPTGALDSDTSKIIMDIFTSLNRDNHTTIILVTHDRKVAEKADRIIHILDGRI----QHEEVIK
2FGJ Chain:C ((24-231))
-------------------ILDNINLSIKQGEVIGIVGRSGSGKSTLTKLIQRFYIPENGQVLIDGHDLALADPNWL----RRQVGVVLQDNVLL-NRSIIDNIS--LANPGMS-------VEKVIYAAKLAGAHDFISELREGYNTIVGEQGAGLSGGQRQRIAIARALVNNPKILIFDEATSALDYESEHVIMRNMHKICKGR--TVIIIAARLSTVKNADRIIVMEKGKIVEQGKHKELL-
General information:
TITO was launched using:
RESULT:
Template:
2FGJ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -101881 for 1442 contacts (-70.7/contact) +
2D Compatibility (PS) -20543 + (NN) -4141 + (LL) 2416
1D Compatibility (HY) -18800 + (ID) 3850
Total energy: -146799.0 ( -101.80 by residue)
QMean score : 0.445
(partial model without unconserved sides chains):
PDB file :
Tito_2FGJ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2FGJ-query.scw
PDB file :
Tito_Scwrl_2FGJ.pdb
: