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



Input alignment information:
Query sequenceMLRLQFHKKLPFHDLNIDYTFEKPVTAMMGASGSGKSTLFQCVSGLKSIDGGIIEFDGTPWDDSNISLHLPVTERKVGYLFQNLALFPNMNVYENIAFGLKVKKKKKKEQAEIQQQVRKMSDYLQISHLLYSSVQKLSGGEKQRVAMARAMITEPKLLLLDEPFNGLDEETRLICMKLVGQMAKDFHIPVIFVTHYASEAEMMTEEILVMREGRLEKRKS
3PUX Chain:A ((21-214))-------------DINLD-IHEGEFVVFVGPSGCGKSTLLRMIAGLETITSGDLFIGEKRMNDT------PPAERGVGMVFQSYALYPHLSVAENMSFGLKLAGAKKEV---INQRVNQVAEVLQLAHLLDRKPKALSGGQRQRVAIGRTLVAEPSVFLLDEPLSNLDAALRVQMRIEISRLHKRLGRTMIYVTHDQVEAMTLADKIVVLDAGRVAQ---


General information:
TITO was launched using:
RESULT:

Template: 3PUX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -125477 for 1465 contacts (-85.6/contact) +
2D Compatibility (PS) -21108 + (NN) -9252 + (LL) 2384
1D Compatibility (HY) -19600 + (ID) 3700
Total energy: -176753.0 ( -120.65 by residue)
QMean score : 0.555

(partial model without unconserved sides chains):
PDB file : Tito_3PUX.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3PUX-query.scw
PDB file : Tito_Scwrl_3PUX.pdb: