Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MLYKKRRFFMSKNNNTTCLIETAIFAALAMALSMIPDFA-SWFTPSFGAIPLILFALRRGTKYGLFAGLIWGLLHFVLSKVYYLSLSQVFIEYILAFISMGLAGVFSAKFKDALSSSSKTKALSLA--LSGAILATFVRYVWHYIAGVIFWASYAPKGMSATLYSLSVNGTAGLLTLFFVVISIIILVISYPSFFLPKK
4POV Chain:A ((17-188))
--------------NVRLLTEIAFMAALAFIISLIPNTVYGWIIVEIACIPILLLSLRRGLTAGLVGGLIWGILSMITGHAYILSLSQAFLEYLVAPVSLGIAGLF----------RQKTAPLKLAPVLLGTFVAVLLKYFFHFIAGIIFWSQYAWKGWGAVAYSLAVNGISGILTAIAAFVILIIFVKKFPKLFIHSN
General information:
TITO was launched using:
RESULT:
Template:
4POV.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -194893 for 1348 contacts (-144.6/contact) +
2D Compatibility (PS) -17345 + (NN) -5467 + (LL) 1716
1D Compatibility (HY) -25600 + (ID) 3850
Total energy: -245439.0 ( -182.08 by residue)
QMean score : 0.273
(partial model without unconserved sides chains):
PDB file :
Tito_4POV.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4POV-query.scw
PDB file :
Tito_Scwrl_4POV.pdb
: