Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLLSWLTVLGAGMVVLHFLQKLLFPYFWDDFWFVLKVVLIIIRLKKYEKRGELVTVLDKFLSHAKRQPRKPFIIYEGDIYTYQDVDKRSSRVAHVFLNHSSLKKGDTVALLMSNEPDFVHVWFGLAKLGCVVAFLNTNIRSNSLLNCIRACGPRALVVGADLLGTVEEILPSLSENISVWGMKDSVPQGVISLKEKLSTSPDEPVPRSHHVVSLLKSTCLYIFTSGTTGLPKAAVISQLQVLRGSAVLWA--FGCTAHDIVYITLPLYHSSAAILGISGCVELGATCVLKKKFSASQFWSDCKKYDVTVFQYIGELCRYLCKQSKREGEKDHKVRLAIGNGIRSDVWREFLDRFGNIKVCELYAATESSISFMNYTG-----RIGAIGRTNLFYKLLSTFDLIKYDFQKDEPMRNEQGWCIHVKKGEPGLLISRVNAKNPFFGYAGPYKHTKDKLLCDVFKKGDVYLNTGDLIVQDQDNFLYFWDRTGDTFRWKGENVATTEVADVIGMLDFIQEANVYGVAISGYEGRAGMASIIL-KPNTSLDLEKVYEQVVTFLPAYACPRFLRIQEKMEATGTFKLLKHQLVEDGFNPLKISEPLYFMDNLKKSYVLLTRELYDQIMLGEIKL |
5BUS Chain:A ((11-479)) | -----------------------------------------------------------LMQRAQLTPERIALIYEDQTVTFAELFAASKRMAEQLAAHS-VRKGDTAAILLQNRAEMVYAVHACFLLGVKAVLLNTKLSTHERLFQLEDSGSGFLLTDSSFEKKEYEHIVQ-----------------TIDVDELMKEAAEEIEIEAYMQ---MDATATLMYTSGTTGKPK-GVQQTFGNHYFSAVSSALNLGITEQDRWLIALPLFHIS-GLSALFKSVIYGMTVVLHQRFSVSDVLHSINRHEVTMISAVQTMLASLLEETNRCPESIRCILLG-GGPAPLPLLEECREK--GFPVFQSYGMTETCSQIVTLSPEFSMEKLGSAGK-----PLFSCEIKIERDGQVCEPYEH----------GE--IMVKGPNVMKSYFNRESANEAS--------FQNG--WLKTGDLGYLDNEGFLYVLDRRSDLIISGGENIYPAEVESVLLSHPAVAEAGVSGAEDKK---KVPHAYLVLHKPVSAGELTDYCKER---LAKYKIPAKFFVLDRLPRNASNKLLRNQLKDARKGEL---------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 5BUS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -288777 for 3885 contacts (-74.3/contact) +
2D Compatibility (PS) -48564 + (NN) -12195 + (LL) 12168
1D Compatibility (HY) -24800 + (ID) 6200
Total energy: -368368.0 ( -94.82 by residue)
QMean score : 0.384
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