Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MDISQIKAEVVTPETGIHVGEKAAPVKVMSFVNLRCPFCREWNEKSKDVLTEYIQAGKIELIIKPFDKEKE-SLQRGNVTHRYLDYSTPEKTRETINKIYSKQDEWGSLSLDEVATYMESELGLTEQ---------DNKAASEKIVAEANAANVVFVPTVIVGEHIFDEHISPEELRSLLDDELAK
3GYK Chain:A ((2-173))
---NANRDSLFNDPNAPVLGNPEGDVTVVEFFDYNCPYCRRAMAEVQGLVDAD---PNVRLVYREWPILGEGSDFAARAALAAR---QQGKYEAFHWALMGMSGKA---NETGVLRIAR-EVGLDTEQLQRDMEAPEVTAHIAQSMALAQKLGFNGTPSFVVEDALVPGFVEQSQLQDAVDRARK-
General information:
TITO was launched using:
RESULT:
Template:
3GYK.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -49167 for 1279 contacts (-38.4/contact) +
2D Compatibility (PS) -17352 + (NN) -5575 + (LL) 804
1D Compatibility (HY) -6800 + (ID) 1150
Total energy: -79240.0 ( -61.95 by residue)
QMean score : 0.517
(partial model without unconserved sides chains):
PDB file :
Tito_3GYK.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GYK-query.scw
PDB file :
Tito_Scwrl_3GYK.pdb
: