Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTLLEKINETRDFLQAKGVTAPEFGLILGSGLGELAEEIENPIVVDYADIPNWGQSTVVGHAGKLVYGDLSGRKVLALQGRFHFYEGNTMEIVTFPVRIMRALACHSVLVTNAAGGIG--YGPGTLMLIKDHINV---IGTNPLIGENLEEFGPRFPDMSDAYTATYRQKA----HQIAEKQNIKLEEGVYLGVSGPTYETPAEIRAFQTMGAQAVGMSTVPEVIVAAHSGLKVLGISAITN-FAAGFQSELNHEEVVEVTQRIKEDFKGLVKSLVAEL
3GB9 Chain:B ((30-304))
----EDYKNTAEWLLSHTKHRPQVAIICGSGLGGLTDKLTQAQIFDYGEIPNFPRST-----GRLVFGFLNGRACVMMQGRFHMYEGYPLWKVTFPVRVFHLLGVDTLVVTNAAGGLNPKFEVGDIMLIRDHINLPGFSGQNPLRGPNDERFGDRFPAMSDAYDRTMRQRALSTWKQMGEQR--ELQEGTYVMVAGPSFQTVAECRVLQKLGADAVGMSTVPEVIVARHCGLRVFGFSLITDKVIMDYE----------AGKQAAQKLEQFVSILMASI
General information:
TITO was launched using:
RESULT:
Template:
3GB9.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -149944 for 2019 contacts (-74.3/contact) +
2D Compatibility (PS) -26085 + (NN) -4747 + (LL) 2048
1D Compatibility (HY) -27600 + (ID) 5800
Total energy: -212128.0 ( -105.07 by residue)
QMean score : 0.532
(partial model without unconserved sides chains):
PDB file :
Tito_3GB9.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GB9-query.scw
PDB file :
Tito_Scwrl_3GB9.pdb
: