Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MLRALKEDFFLTLTSLKNQFWVYIGTGILIQTLVAYLVKGILSFIFRRILILSNTPAVTKDNWTLLFNHPLALLLFILYIVILIGFIYTEFAIYTIAILKTEFSLSIKKWLTIFPKKIKSLLGPQLIWVSIYLLLTIPLANLGLRSSILEHLKIPDFISGELTKTVFGKIGYSTLLLLICYLNLRLIYFLPLTILTDYNAKEALLESWKLSRGKHQWRLLSKIILTSLFISVIGTVALAVVAGTSSFIDHSGNNFPLQATFYNLLKSILFAVTLLIKCLIISHLLADIKQNKSIVQQWRAWKGVQHKQKFKHIACVILALAIGTTALKNAIALALLQDNISIKKELIAHRG--DTSHGVENSIEALKAAHKAKADYSEMDVIMTKDHKLVVIHDDNLKRLSGMNKDVSKLTLDQVTKIPIHQGRFASHIPSFAEFMKTAQSLDQ-KIMIELKPYN---QNLDIYADEFIKEFKELRLSTKHKVMSLNLTLIEKVEKKLPQLDTGY----LIPLHWGTLQNHNVDFYGIEEFSYNDWI---AYLAQEYNKQLYVWTINRDNLMIRYLQSPVNGIITDELNLFKVINKDIKNSPNYYQRALQLIDSEG |
| 3NO3 Chain:A ((6-224)) | --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KVIAHRGYWKTEGSAQNSIRSLERASEIGAYGSEFDVHLTADNVLVVYHDNDIQ-----GKHIQSCTYDELKDLQLSNG---EKLPTLEQYLKRAKKLKNIRLIFELKSHDTPERNRDA-ARLSVQMVKRMKLAKRTDYISFNMDACKEFIRLCPKSEVSYLNGELSPMELKELGFTGLDYHYKVLQSHPDWVKDCKVLGMTSN----VWTVDDPKLMEEMIDMGVDFITTDLPEETQKILHSRAQ---------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3NO3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -66390 for 1693 contacts (-39.2/contact) +
2D Compatibility (PS) -22225 + (NN) -5897 + (LL) 34820
1D Compatibility (HY) -16400 + (ID) 3050
Total energy: -79142.0 ( -46.75 by residue)
QMean score : 0.384
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