Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPSSKPLAEYARKRDFRQTPEPSGRKPRKDSTGLLRYCVQKHDASRLHYDFRLELDGTLKSWAVPKGPCLDPAVKRLAVQVEDHPLDYADFEGSIPQGHYGAGDVIVWDRGAWTPLDDPREGLEKGHLSFALDGEKLSGRWHLIRTNLRGKQSQWFLVKAKDGEARSLDRFDVLKERPDSVLSERTLLPRHGEAATPAARPARRGKSGGKTPMPEWIAPELA--------SLVEQPPRGEWAYELKLDGYRLMSRIEDGHVRLLTRNGHDWTERLPHLEKAL-AGLGLQRSWLDGELVVLDEEGRPD-FQALQNAFEEGRGENILYV---------LFDLPYHEGEDLRDVALEERRARLEALLEGRDEDPLRFSATL----AEDPRDLLASACKLGLEGVIGKRLGSAYR-SRRSNDWIKLKCQLRQ-EFVIVGYTEPKGSRRH-IGALLLGLYSPDEERRLRYAGKVGSGFTAASLKKVRERLEPLAVRSSPLAKVPPARETGSVQWVRPQQLCEVSYAQMTR------GGIIRQAVFHGLREDKPAREV-TGERPAGPPPLRGARKASAGASRAATAGVRISHPQRLIDPSIQASKLELAEFHARYADLLLRDLRERPVSLVRGPDGIGGELFFQKHAARLKIPGIVQLDPALDPGHPPLLQIRSAEALVGAVQMGSIEFHTWNASLANLERPDRFVLDLDPDPALPWKRMLEATQLSLTLLDELGLRAFLKTSGGKGMHLLVPLERRHGWDEVKDFAQAISQHLARLMPERFSAVSGPRNRVGKIFVDYLRNSRGASTVAAYSVRAREGLPVSVPVFREELDSLQGANQWNLRSLPQRLDELAGDDPWADYAGTRQRISAAMRRQLGRG |
3RR5 Chain:A ((188-564)) | ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------EAFRVKPELVERAYMLTSDFGYVAKVAKLEGNEGLSKVSIQIGKPIRPMLAQNAASVKEALIEMG--GEAAFEIKYDGARVQVHRDGDRVIIYSRRLENVTRSIPEIVEAVKASLKPSKVIVEGELVAVGENGRPRPFQYVLRRFR--RKYNIDEMIEKIPLELNLFDILYVDGESLIDTEFVERRKRLEESVE--ESEKIKIAEQLVTKKVEEAEAFYKRALELGHEGLMAKRLDSVYEPGNRGKKWLKIKPTMENLDLVIIGAEWGEGRRAHLLGSFLVAAYDPDSGEFLP-VGKVGSGFTDEDLVEFTKMLKPLIL-----------REEGKFVEIEPKVVIEVTYQEIQKSPKYRSGFALRFPRYVALREDKSPEEADTIERIAQLYELQE------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3RR5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -71415 for 2528 contacts (-28.2/contact) +
2D Compatibility (PS) -36436 + (NN) -11615 + (LL) 28664
1D Compatibility (HY) -23600 + (ID) 5950
Total energy: -120352.0 ( -47.61 by residue)
QMean score : 0.363
|
|
|