Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRVAVLSGAGISAESGVPTFRDDKNGLWARFDPYELSSTQGWLRNPERVWGWYLWRHYLVANVEPNDGHRAIAAWQDH-AEVSVITQNVDDLHERAGSGAVHHLHGSLFEFRCARCGVPYTDALPEMPE--PAIEVEPPVCDCGGLIRPDIVWFGEPLPEEPWRSAVEATGSADVMVVVGTSAIVYPAAGLPDLALARGTAVIEVNPEPTPLSG-SATISIRESASQALPGLLERLPALLK
3U31 Chain:A ((46-281))
KHVVALTGSGTSAESNIPSFRGSSNSIWSKYDPRIYGTIWGFWKYPEKIWEVIRDISSD-YEIEINNGHVALSTLESLGYLKSVVTQNVDGLHEASGNTKVISLHGNVFEAVCCTCNKIVKLNKIMLQKTSHFMHQLPPECPCGGIFKPNIILFGEVVSSDLLKEAEEEIAKCDLLLVIGTSSTVSTATNLCHFACKKKKKIVEINISKTYITNKMSDYHVCAKFSE-LTKVANILKG---
General information:
TITO was launched using:
RESULT:
Template:
3U31.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -104174 for 1892 contacts (-55.1/contact) +
2D Compatibility (PS) -24479 + (NN) -8877 + (LL) 752
1D Compatibility (HY) -16000 + (ID) 3550
Total energy: -156328.0 ( -82.63 by residue)
QMean score : 0.509
(partial model without unconserved sides chains):
PDB file :
Tito_3U31.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3U31-query.scw
PDB file :
Tito_Scwrl_3U31.pdb
: