Job name:

4H3Z chain A

3ad5ef6e-45bf-41cd-bfce-94f23d10638a
Finished
Electron density map:

Differential EDM:
Show only modeled chain
Models Number of gaps:1 Gap lengths: 7
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap
Model 1 Non-trivial -61681
Model 2 Non-trivial -61251
Model 3 Non-trivial -61210
Model 4 Non-trivial -61168
Model 5 Non-trivial -60931
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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
EntanglementHelpKnotProtLassoProtLinkProt
Model Type Knot core Slipknot Lasso Piercing Show
range loop range loop position in JSmol
Model 1 Knot K 31 91-136 -- -- --
Model 2 Knot K 31 91-136 -- -- --
Model 3 Knot K 31 91-136 -- -- --
Model 4 Knot K 31 91-136 -- -- --
Model 5 Knot K 31 91-136 -- -- --
None
Topologies marked by an OK sign () are in accordance with the template topology.
Warning: Entanglement type is assigned automatically - for more complicated topologies there may be some disagreements with manually curated databases.
Model 1
Model 2
Model 3
Model 4
Model 5
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


4H3Y

A

K +31

100.00%

100.00%

100.00%

1.06

..Target: SMQFDIVTLFPDMFRALTDWGITSRAAKQERYGLRTWNPRDFTTDNYRTIDDRPYGGGPGMVMLARPLEDAINAAKAAQAEQGIGGARVVMMSPQGATLNHDKVMRFAAEPGLILLCGRYEAIDQRLIDRVVDEEVSLGDFVLSGGELPAMALIDAVVRHLPGVLNDAQSAVQDSFVDGLLDCPHYTRPEEYDGVRVPDVLLGGHHAEIEQWRRREALRNTWLKRPDLIVQARKNKLLSRADEAWLASLAKDASK
Template: SMQFDIVTLFPDMFRALTDWGITSRAAKQERYGLRTWNPRDFTTDNYRTIDDRPYGGGPGMVMLARPLEDAINAAKAAQAEQGIGGARVVMMSPQGATLNHDKVMRFAAEPGLILLCGRYEAIDQRLIDRVVDEEVSLGDFVLSGGELPAMALIDAVVRHLPGVLNDAQSAVQDSFVDGLLDCPHYTRPEEYDGVRVPDVLLGGHHAEIEQWRRREALRNTWLKRPDLIVQARKNKLLSRADEAWLASLAKDASK

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

VLNDAQSAVQDSF

4H3Y A K +31 100.00% 100.00%

VLNDAQSAVQDSF


Thu Feb 15 10:45:17 2018	JOB CREATED : 3ad5ef6e-45bf-41cd-bfce-94f23d10638a
Thu Feb 15 10:46:01 2018	STATUS CHANGED : N -> R
Thu Feb 15 10:46:01 2018	INFO : JOB STARTED AT: 2018-02-15 10:46:01.589715
Thu Feb 15 10:46:01 2018	INFO : METHOD: 1
Thu Feb 15 10:46:02 2018	INFO : Precalculated profile found...
Thu Feb 15 10:46:02 2018	INFO : Homologue pool found...
Thu Feb 15 10:46:02 2018	INFO : Verifying structure sequences of homologues...
Thu Feb 15 10:46:37 2018	INFO : Starting homologue filtering...
Thu Feb 15 10:47:01 2018	INFO : Getting structures from PDB...
Thu Feb 15 10:47:04 2018	INFO : Creating modelling alignment...
Thu Feb 15 10:47:04 2018	INFO : Adding other chains
Thu Feb 15 10:47:04 2018	INFO : Modelling...
Thu Feb 15 10:53:38 2018	INFO : Model 1 built
Thu Feb 15 10:53:38 2018	INFO : Validating Calpha distances...
Thu Feb 15 10:53:39 2018	INFO : Model 1 distances correct: True
Thu Feb 15 10:53:39 2018	INFO : Modelling...
Thu Feb 15 11:00:17 2018	INFO : Model 2 built
Thu Feb 15 11:00:17 2018	INFO : Validating Calpha distances...
Thu Feb 15 11:00:17 2018	INFO : Model 2 distances correct: True
Thu Feb 15 11:00:17 2018	INFO : Modelling...
Thu Feb 15 11:04:12 2018	INFO : Model 3 built
Thu Feb 15 11:04:12 2018	INFO : Validating Calpha distances...
Thu Feb 15 11:04:12 2018	INFO : Model 3 distances correct: True
Thu Feb 15 11:04:12 2018	INFO : Modelling...
Thu Feb 15 11:08:05 2018	INFO : Model 4 built
Thu Feb 15 11:08:05 2018	INFO : Validating Calpha distances...
Thu Feb 15 11:08:05 2018	INFO : Model 4 distances correct: True
Thu Feb 15 11:08:05 2018	INFO : Modelling...
Thu Feb 15 11:12:06 2018	INFO : Model 5 built
Thu Feb 15 11:12:06 2018	INFO : Validating Calpha distances...
Thu Feb 15 11:12:06 2018	INFO : Model 5 distances correct: True
Thu Feb 15 11:12:46 2018	INFO : Finished modelling
Thu Feb 15 11:12:46 2018	STATUS CHANGED : R -> P
Thu Feb 15 11:12:46 2018	INFO : Checking topology...
Thu Feb 15 11:15:11 2018	INFO : Knot matrices done...
Thu Feb 15 11:17:49 2018	INFO : Some knots found!
Thu Feb 15 11:17:49 2018	INFO : No lassos found...
Thu Feb 15 11:17:49 2018	INFO : Finishing...
Thu Feb 15 11:17:49 2018	STATUS CHANGED : P -> E
Thu Feb 15 11:17:49 2018	ERROR : Error while finishing
Thu Feb 15 11:17:49 2018	STATUS CHANGED : E -> F

GapRepairer | Interdisciplinary Laboratory of Biological Systems Modelling