Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
LELPFSGQSIIPAAHNQKDMEKILELGLTYMVMLETHVAQLKSLVKYAQAGGKKVLLHADLVNGLKNDDYAIDFLCTEICPDGIISTRGNAIMKAKQHKMLAIQRLFMIDSSACNKGVALIQKVQPDCIELLPGIIPEQVQKMTQKLHIP---VIAGGLIETSEQVNQVIASGAIAVTTSNKHLW
1VKF Chain:B ((35-182))
------------------------------VFLLKSDILNLKFHLKILKDRGKTVFVDMDFVNGLGEGEEAILF-VKKAGADGIITIKPKNYVVAKKNGIPAVLRFFALDSKAVERGIEQIETLGVDVVEVLPGAVAPKVAR-----KIPGRTVIAAGLVETEEEAREILKHVS-AISTSSRILW
General information:
TITO was launched using:
RESULT:
Template:
1VKF.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -112666 for 1127 contacts (-100.0/contact) +
2D Compatibility (PS) -15086 + (NN) -2286 + (LL) 3152
1D Compatibility (HY) -14800 + (ID) 2500
Total energy: -144186.0 ( -127.94 by residue)
QMean score : 0.469
(partial model without unconserved sides chains):
PDB file :
Tito_1VKF.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1VKF-query.scw
PDB file :
Tito_Scwrl_1VKF.pdb
: