Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MDLFADAPLTLPDADLRYLPHWLDAPLASAWLLRLEQETPWEQPIL---RIHGEEHPTPRLVAWYGDPDAAYRYSGQVHRPLPWTALLGEIRERVEREVGQRVNGVLLNYYRDGQDSMGWHSDDEPELRRDPLVASLSLGGSRRFDLRRK---GQT---RIAHS-LELTHGSLLVMRGATQHHWQHQVAKTRRSCMPRLNLTFRLVYPQP
3BTZ Chain:A ((29-200))
----------------------------------LEKEVEYFTGALARVQVFGKWHSVPRKQATYGDAGLTYTFSGLTLSPKPWIPVLERIRDHVSGVTGQTFNFVLINRYKDGSDHIGEHRDDCRELAPGSPIASVSFGASRDFVFRHKDSRGKSPSRRVAVVRLPLAHGSLLMMNHPTNTHWYHSLPVRKKVLAPRVNLTFRKI----
General information:
TITO was launched using:
RESULT:
Template:
3BTZ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -40705 for 1115 contacts (-36.5/contact) +
2D Compatibility (PS) -16989 + (NN) -3022 + (LL) 2452
1D Compatibility (HY) -10400 + (ID) 3450
Total energy: -72114.0 ( -64.68 by residue)
QMean score : 0.376
(partial model without unconserved sides chains):
PDB file :
Tito_3BTZ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3BTZ-query.scw
PDB file :
Tito_Scwrl_3BTZ.pdb
: