Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNEPIILRYFPVLGRAQALRHALADAELAFRDLRIPLEQWSQHKDSDAGGPYGSLPTLRWHGVEVAETIAIASFLARSLGHYEGRDNGEIARLEAVVSLCYTEVSLQIAQLLWLDLFNPGVDLAAAVPLQFGRLVARLTRLEAHTPEAGWFGGERPVMADYFAAEAIEALRYLLGREHDDALRTRLPHLCALARRMAQRPALAQAWSTRPQTFTAHPDEAAMLERLRALPLAATIGASME
2OAC Chain:A ((2-197))
---PYTIVYFPVRGRAEAMRMLLADQGQSWKEEVVTIDTWMQGLLKPT-CLYGQLPKFEDGDLTLYQSNAILRHLGRSLGLY-GKNQREAAQMD-MVNDGVEDLRGKYVTLIYTNYENGKNDYVKALP---GHLKPFETLLSQNQGGKAFIVGDQISFADYNLLDLL-----LIHQVLAPGCLDNFPLLSAYVARLSARPKI-KAFLSSPE-----------------------------
General information:
TITO was launched using:
RESULT:
Template:
2OAC.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -101425 for 1450 contacts (-69.9/contact) +
2D Compatibility (PS) -21961 + (NN) -17361 + (LL) 4116
1D Compatibility (HY) -11600 + (ID) 2650
Total energy: -150881.0 ( -104.06 by residue)
QMean score : 0.402
(partial model without unconserved sides chains):
PDB file :
Tito_2OAC.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2OAC-query.scw
PDB file :
Tito_Scwrl_2OAC.pdb
: