Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAVHGFLLERVSVVRDE-ATVLRQVSAHFPAGRCSAVRGASGSGKTTLLRLLNRLIDPTSGKVWLDGVPLTDLDVLVLRRRVGLVAQAPVVLTDAVLNEVRVGRPDLPEGRVTELLARLCLGQSAR----------------EAFLPHQRSALRTALIPAIDSTKVVGLISLPGAMSGLILAGVDPLTAIRYQIVVMYLLLAATAVAALTCARLAERALFDRAHRLVSLPAATRRA
4MRS Chain:A ((360-537))
----SVTFDNVVFGYDRDREILHGLSFEVAAGSRVAIVGPSGAGKSTIARLLFRFYDPWEGRILIDGQDIAHVTQTSLRAALGIVPQDSVLFNDTIGYNIAYGRDGASRAEVDAAAKGAAIADFIARLPQGYDTEVGERGLKLSGGEKQRVAIARTLVK-----------NPPILLFDEATSALDTRTEQDIL-------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
4MRS.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -93958 for 1147 contacts (-81.9/contact) +
2D Compatibility (PS) -17346 + (NN) -6837 + (LL) 6796
1D Compatibility (HY) -6000 + (ID) 1950
Total energy: -119295.0 ( -104.01 by residue)
QMean score : 0.364
(partial model without unconserved sides chains):
PDB file :
Tito_4MRS.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4MRS-query.scw
PDB file :
Tito_Scwrl_4MRS.pdb
: