Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKPVIGITGNRLVKGVDVFYGHRVTYTQQRYVDAIQKVGGFPIALPIDDPSVAVQ-AISLVDGLLLTGGQDITPQFYLEEPSQEIGAYFPPRDSYEIALVRAALDAGKPIFAICRGMQLVNVALGGSLYQDISQVETKALQHLQRVDEQLGSHTIDIEPTSELAKHHPNKKLVNSLHHQFIKKLAPSFKVTARTADGMIEAVEGDNLPSWYLGVQWHPELMFQTDPESEQLFQALVDESKKTMVK
2VPI Chain:A ((39-214))
----------------------------KVIDRRVRELFVQSEIFPLETP--AFAIKEQGFRAIIISG-------------APW--------------FDPAIFTIGKPVLGICYGMQMMNKVFGGTVHKKSVR--------------EDGVFNISVDNTCSLFRGLQKEEVVLLTHGDSVDKVADGFKVVARS-GNIVAGIANE--SKKLYGAQFHPEVGLT--ENGKVILKNFLYDIAGCS--
General information:
TITO was launched using:
RESULT:
Template:
2VPI.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -74709 for 1344 contacts (-55.6/contact) +
2D Compatibility (PS) -17719 + (NN) -6241 + (LL) 5116
1D Compatibility (HY) -10400 + (ID) 1700
Total energy: -105653.0 ( -78.61 by residue)
QMean score : 0.364
(partial model without unconserved sides chains):
PDB file :
Tito_2VPI.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2VPI-query.scw
PDB file :
Tito_Scwrl_2VPI.pdb
: