Job name:

1XJD chain A

821121e7-902e-4b22-9686-bef35aafe611
Finished
Models Number of gaps:1 Gap lengths: 39
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap
Model 1 Unknot -40477
Model 2 Unknot -40179
Model 3 Unknot -40082
Model 4 Unknot -39843
Model 5 Unknot -39833
Reload
Warning: All models are renumbered - the first residue in the structure has index 1.
Mix & match
Provided protein had only one gap - thus there are no gap-filling combinations to be made.

Pro Tip: Since you provided a structure that contains some crystallographic information you can verify our models using the wwPDB service.
Validity report for the RCSB PDB structure you were repairing can be accessed here
DOPE (Discrete Optimized Protein Energy) score per residue. The lower the score, the better.
Since DOPE is calculated against the neighbours of a given amino acid, the scores
can vary between unmoved segments of different models. See here for more information.
PDB
code
Chain Entanglement
type
Seq
identity
Total gap
coverage
Total gap
identity
RMSD [Å] Pairwise alignment to the target: gap


2JED

A

Unknot

97.24%

100.00%

97.44%

0.86

..Target: --IEDFILHKMLGKGSFGKVFLAEFKKTNQFFAIKALKKDVVLMDDDVECTMVEKRVLSLAWEHPFLTHMFCTFQTKENLFFVMEYLNGGDLMYHIQSCHKFDLSRATFYAAEIILGLQFLHSKGIVYRDLKLDNILLDKDGHIKIADFGMCKENMLGDAKTNXFCGTPDYIAPEILLGQKYNHSVDWWSFGVLLYEMLIGQSPFHGQDEEELFHSIRMDNPFYPRWLEKEAKDLLVKLFVREPEKRLGVRGDIRQHPLFREINWEELERKEIDPPFRPKVKSPFDCSNFDKEFLNEKPRLSFADRALINSMDQNMFRNFXF----
Template: LKIEDFELHKMLGKGSFGKVFLAEFKKTNQFFAIKALKKDVVLMDDDVECTMVEKRVLSLAWEHPFLTHMFCTFQTKENLFFVMEYLNGGDLMYHIQSCHKFDLSRATFYAAEIILGLQFLHSKGIVYRDLKLDNILLDKDGHIKIADFGMCKENMLGDAKTNEFCGTPDYIAPEILLGQKYNHSVDWWSFGVLLYEMLIGQSPFHGQDEEELFHSIRMDNPFYPRWLEKEAKDLLVKLFVREPEKRLGVRGDIRQHPLFREINWEELERKEIDPPFRPKVKSPFDCSNFDKEFLNEKPRLXFADRALINSMDQNMFRNFXFMNPG

PDB
code
Chain Knot
type
Gap
coverage
Gap
identity
>Target_Sequence: gap

IDPPFRPKVKSPFDCSNFDKEFLNEKPRLSFADRALINSMDQNMF

2JED A Unknot 97.44% 100.00%

IDPPFRPKVKSPFDCSNFDKEFLNEKPRLXFADRALINSMDQNMF


Fri Dec  1 09:45:19 2017	JOB CREATED : 821121e7-902e-4b22-9686-bef35aafe611
Fri Dec  1 21:37:02 2017	STATUS CHANGED : N -> R
Fri Dec  1 21:37:02 2017	INFO : JOB STARTED AT: 2017-12-01 21:37:02.214600
Fri Dec  1 21:37:02 2017	INFO : METHOD: 1
Fri Dec  1 21:37:02 2017	INFO : Precalculated profile found...
Fri Dec  1 21:37:02 2017	INFO : Homologue pool found...
Fri Dec  1 21:37:02 2017	INFO : Verifying structure sequences of homologues...
Sat Dec  2 00:03:46 2017	INFO : Starting homologue filtering...
Sat Dec  2 00:04:45 2017	INFO : Getting structures from PDB...
Sat Dec  2 00:04:49 2017	INFO : Creating modelling alignment...
Sat Dec  2 00:04:49 2017	INFO : Modelling...
Sat Dec  2 00:11:49 2017	INFO : Model 1 built
Sat Dec  2 00:11:49 2017	INFO : Validating Calpha distances...
Sat Dec  2 00:11:49 2017	INFO : Model 1 distances correct: True
Sat Dec  2 00:11:49 2017	INFO : Modelling...
Sat Dec  2 00:23:16 2017	INFO : Model 2 built
Sat Dec  2 00:23:16 2017	INFO : Validating Calpha distances...
Sat Dec  2 00:23:16 2017	INFO : Model 2 distances correct: True
Sat Dec  2 00:23:16 2017	INFO : Modelling...
Sat Dec  2 00:30:23 2017	INFO : Model 3 built
Sat Dec  2 00:30:23 2017	INFO : Validating Calpha distances...
Sat Dec  2 00:30:23 2017	INFO : Model 3 distances correct: True
Sat Dec  2 00:30:23 2017	INFO : Modelling...
Sat Dec  2 00:42:08 2017	INFO : Model 4 built
Sat Dec  2 00:42:08 2017	INFO : Validating Calpha distances...
Sat Dec  2 00:42:08 2017	INFO : Model 4 distances correct: True
Sat Dec  2 00:42:08 2017	INFO : Modelling...
Sat Dec  2 00:49:07 2017	INFO : Model 5 built
Sat Dec  2 00:49:07 2017	INFO : Validating Calpha distances...
Sat Dec  2 00:49:07 2017	INFO : Model 5 distances correct: True
Sat Dec  2 00:49:50 2017	INFO : Finished modelling
Sat Dec  2 00:49:50 2017	STATUS CHANGED : R -> P
Sat Dec  2 00:49:50 2017	INFO : Checking topology...
Sat Dec  2 00:51:04 2017	INFO : Knot matrices done...
Sat Dec  2 00:51:04 2017	INFO : No knots found...
Sat Dec  2 00:51:04 2017	INFO : No lassos found...
Sat Dec  2 00:51:04 2017	INFO : Finishing...
Sat Dec  2 00:51:04 2017	STATUS CHANGED : P -> E
Sat Dec  2 00:51:04 2017	ERROR : Error while finishing
Sat Dec  2 00:51:04 2017	STATUS CHANGED : E -> F

GapRepairer | Interdisciplinary Laboratory of Biological Systems Modelling