Job name:

1II0 chain A

7976ca7f-1010-47d0-9454-429db9e2e017
Finished
Electron density map:

Differential EDM:
Models Number of gaps:3 Gap lengths: 18, 13, 11
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap2nd gap3rd gap
Model 1 Non-trivial -52989
Reload
Warning: All models are renumbered - the first residue in the structure has index 1.
Mix & match
None of the models is perfect? By clicking the button below you can download a .pdb file with the currently shown mix of models - for each gap at most one model can be selected. If none of them is checked, the gap will be left as is. Fourth and further gaps (sorted by size) can only come from one of the models.
EntanglementHelpKnotProtLassoProtLinkProt
Model Type Knot core Slipknot Lasso Piercing Show
range loop range loop position in JSmol
Model 1 Knot K +31 307-565 -- -- --
Lasso SL 2++C -- -- 113-422
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 1
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


3SJC

F

Unknot

28.99%

149.15%

47.44%

1.31

..Target: MQ------FLQNIPPYLFFTGKGGVGKTSISCATAIRLA--EQGKRVLLVSTDPASNVGQVFSQTIGNTIQAIASVPGLSALEIDPQAAAQQYRARIVDPIKGVLPDDVVSSINEQLSGACTTEIAAFDEFTGLLTDASLLTRFDHIIFDTAPTGHTIRLLQLPGAWSSFIDSNPEGASCLGPMAGLEKQREQYAYAVEALSDPKRTRLVLVARLQKSTLQEVARTHLELAAIGLKNQYLVINGVLPKTEAANDTLAAAIWEREQEALANLPADLAGLPTDTLFLQPVNMVGVSALSRLLSTQPVASPSSDEYLQQRPDIPSLSALVDDIARNEHGLIMLMGKGGVGKTTMAAAIAVRLADMGFDVHLTTSDPAAHLSMTLNGSLNNLQVSRIDPHEETERYRQHVLETKGKELDEAGKRLLEEDLRSPCTEEIAVFQAFSRVIREAGKRFVVMDTAPTGHTLLLLDATGAYHREIAKKMGE-KGHFTTPMMLLQDPERTKVLLVTLPETTPVLEAANLQADLERAGIHPWGWIINNSL---SIADTRSPLLRMRAQQE-LPQIESVKRQHASRVALVPVLASEPTGIDKL------------KQLAGH--HHHHH
Template: VEPNLHSLITSTTHKWIFVGGKGGVGKTTSSCSIAIQMALSQPNKQFLLISTDPAHNLSDAFGEKFGKDARKVTGMNNLSCMEID----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PSAAL------------------------------------GSIPGIDEAL-------SFMEVMKHIKRQE-------------------------------------------------------------------------QGEGETFD-----------------------------------TVIFDTAPTGHTLRFLQLPNT-----SGKLNELKANVETIRQQFTDPDLTTFVCVCISEFLSLYETERLIQELISYDMDVNSIIVNQLLFAE----CKRCQARWKMQKKYLDQIDEL--YEDFHVVKMPLCAGEIRGLNNLTKFSQFLNKEYNPITDGKVIYELED


3IDQ

A

Unknot

35.29%

72.73%

36.36%

1.43

..Target: ---MQFLQNIPPYLFFTGKGGVGKTSISCATAIRLA--EQGKRVLLVSTDPASNVGQVFSQTIGNTIQAIASVPGLSALEIDPQAAAQQYRARIVDPIKGVLPDDVVSSINEQLSGACTTEIAAFDEFTGLLTDASLLTRFDHIIFDTAPTGHTIRLLQLPGAWSSFIDS-NPEGASCLGPMAGLEKQREQYAYAVEALSDPKRTRLVLVARLQKSTLQEVARTHLELAAIGLKNQYLVINGVLPKTEAANDTLAAAIWEREQEALANLPADLAGLPTDTLFLQPVNMVGVSALSRLLSTQPVASPSSDEYLQQRPDIPSLSALVDDIARNEHGLIMLMGKGGVGKTTMAAAIAVRLADMGFDVHLTTSDPAAHLSMTL--NGSLNNLQVSRIDPHEETERYRQHVLETKGKELDEAGKRLLEEDLRSPCTEEIAVFQAFSRVIREAGKRFVVMDTAPTGHTLLLLDATGAYHREIAKKMGEKGHFTTPMMLLQDPERTKVLLVTLPETTPVLEAANLQADLERAGIHPWGWIINNSLSIADTRSPLLRMRAQQELPQIESVKRQHASRVALVPVLASEPTGIDKLKQLAG-HHHHHH
Template: NLHSLITSTTHKWIFVGGKGGVGKTTSSCSIAIQMALSQPNKQFLLISTDPAHNLSDAFGEKFGKDARKVTGMNNLSCMEIDDEALS---------------FMEVMKHIKRQEQG--------------------EGETFDTVIFDTAPTGHTLRFLQLPNTLSKLLEKFNELKAN-------VETIRQQ-------FTDPDLTTFVCVCISEFLSLYETERLIQELISYDMDVNSIIVNQLL----FANCKRCQARWKMQKKYL----------------------------------------------------------------------------------------DQIDELYEDFHV--------VKMPLEIRG-LNNL--------------------------------------------------------------------------------------------------------------TKFSQFLNKEYNPI------------------------------TDGKVI-----------------------------------YELEDKEGL-HHHHH


3IO3

A

Unknot

30.87%

92.31%

7.69%

1.22

..Target: --------MQFLQNIP-PYLFFTGKGGVGKTSISCATAIR--LAEQGKRVLLVSTDPASNVGQVFSQTIGNTIQAIASVPGLSALEIDPQAAAQQYRARIVDPIKGVLPDDVVSSINEQLSGACTTEIAAFDEFTGLLTDASLLTRFDHIIFDTAPTGHTIRLLQLPGAWSSFIDSNPEGASCLGPMAGLEKQREQYAYAVEALSDPKRTRLVLVARLQKSTLQEVARTHLELAAIGLKNQYLVINGVLPKTEAANDTLAAAIWEREQEALANLPADLAGLPTDTLFLQPVNMVGVSALSRLLSTQPVASPSSDEYLQQRPDIPSLSALVDDIARNEHGLIMLMGKGGVGKTTMAAAIAVRLADMGFDVHLTTSDPAAHLSMTLNGSLNNLQVSRIDPHEETERYRQHVLETKGKELDEAGKRLLEEDLRSPCTEEIAVFQAFSRVIREAGKRFVVMDTAPTGHTLLLLDATGAYHREIAKKMGEKGHFTTPMMLLQDPERTKVLLVTLPETTPVLEAANLQADLERAGIHPWGWIINNSLSIADTRSPLLRMRAQQELPQIESVKRQHASRVALVPVLASEPTGIDKLKQLAGHHHHHH
Template: DLELEPTLESIVQHDSLKWIFVGGKGGVGKTTTSSSVAVQLALAQPNEQFLLISTDPAHNLSDAFCQKFGKDARKVEGLPNLSCMEIDP---------------------------------------------------------YKTIIFDTAPTGHTLRFLQ--------------------------------SEVNEQFTNPELTTFICVCISEFLSLYETERMIQELMSYNMDVNSIVVN------------------------------------------------------QLLFAE--CKRCESRWKMQKKYLDQMGELYED--------------------------------------------------------------------------YHLVK----------MPLLGCEIRG-----VENLKKFS--------KFLLKPYDPKADSDIVFD--------------------------------------------------------------------------------------------------------------------------------LE


3ZS9

A

Unknot

31.40%

66.67%

22.22%

1.06

..Target: MQ------FLQNIPPYLFFTGKGGVGKTSISCATAIRLA--EQGKRVLLVSTDPASNVGQVFSQTIGNTIQAIASVPGLSALEIDPQAAAQQYR--ARIVDPIKGVLPDDVVSSINEQLSGACTTEIAAFDEFTGLLTDASLLTRFDHIIFDTAPTGHTIRLLQLPGAWSSFIDSNPEGASCLGPMAGLEKQREQYAYAVEALSDPKRTRLVLVARLQKSTLQEVARTHLELAAIGLKNQYLVINGVLPKTEAANDTLAAAIWEREQEALANLPADLAGLPTDTLFLQPVNMVGVSALSRLLSTQPVASPSSDEYLQQRPDIPSLSALVDDIARNEHGLIMLMGKGGVGKTTMAAAIAVRLADMGFDVHLTTSDPAAHLSMTLNGSLNNLQVSRIDPHEETERYRQHVLETKGKELDEAGKRLLEEDLRSPCTEEIAVFQAFSRVIREAGKRFVVMDTAPTGHTLLLLDATGAYHREIAKKMGE-KGHFTTPMMLLQDPERTKVLLVTLPETTPVLEAANLQADLERAGIHPWGWIINNSLSIADT-RSPLLRMRAQQE-LPQIESVKRQHASRVALVPVLASEPTGIDKL------------KQLAGH--HHHHH
Template: VEPNLHSLITSTTHKWIFVGGKGGVGKTTSSCSIAIQMALSQPNKQFLLISTDPAHNLSDAFGEKFGKDARKVTGMNNLSCMEIDPSAALKDMNDMADLTGSIPGI---DEALSFMEVMK-----HIKRQEQGEG--------ETFDTVIFDTAPTGHTLR----------------------------------------------------------------------------------------------------------------------------FLQLPN-----TLSKLL-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ISGKLNELKANVETIRQQFTDPDLTTFVCVCISEFLSLYETERLIQELISYDMDV-NSIIVNQLLFAENCKRCQARWKMQKKYLDQIDEL--YEDFHVVKMPLCAGEIRGLNNLTKFSQFLNKEYNPITDGKVIYELED

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

DATGAYHREIAKKMGE-KGHFTTPM

3SJC F Unknot 16.67% 72.22%

QLPNT-----SGKLNELKANVETIR

3IDQ A Unknot 0.00% 0.00%

------------------------

3IO3 A Unknot 0.00% 0.00%

D-----------------------

3ZS9 A Unknot 22.22% 66.67%

---------ISGKLNELKANVETIR

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

TQPVASPSSDEYLQQRPDI

3SJC F Unknot 30.77% 76.92%

---GSIPGIDEAL------

3IDQ A Unknot 0.00% 0.00%

-------------------

3IO3 A Unknot 7.69% 92.31%

AE--CKRCESRWKMQKKYL

3ZS9 A Unknot 0.00% 0.00%

-------------------

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

DPAAHLSMTLNGSLNNL

3SJC F Unknot 0.00% 0.00%

-----------------

3IDQ A Unknot 36.36% 72.73%

-----VKMPLEIRG-LNNL

3IO3 A Unknot 0.00% 0.00%

-----------------

3ZS9 A Unknot 0.00% 0.00%

-----------------


Models
Similarity profile
Modelling alignment
Raw knot fingerprint matrices:
Model_1

Sun Jul 23 14:55:38 2017	JOB CREATED : 7976ca7f-1010-47d0-9454-429db9e2e017
Sun Jul 23 16:27:02 2017	STATUS CHANGED : N -> R
Sun Jul 23 16:27:02 2017	INFO : JOB STARTED AT: 2017-07-23 16:27:02.562756
Sun Jul 23 16:27:02 2017	INFO : METHOD: 1
Sun Jul 23 16:27:02 2017	INFO : Precalculated profile found...
Sun Jul 23 16:27:02 2017	INFO : Homologue pool found...
Sun Jul 23 16:27:02 2017	INFO : Verifying structure sequences of homologues...
Sun Jul 23 16:32:15 2017	INFO : Starting homologue filtering...
Sun Jul 23 16:33:10 2017	INFO : Getting structures from PDB...
Sun Jul 23 16:33:21 2017	INFO : Creating modelling alignment...
Sun Jul 23 16:33:21 2017	INFO : Modelling...
Sun Jul 23 17:06:23 2017	INFO : Model 1 built
Sun Jul 23 17:06:23 2017	INFO : 3 gaps will be remodelled
Sun Jul 23 17:33:15 2017	INFO : Validating Calpha distances...
Sun Jul 23 17:33:15 2017	INFO : Model 1 distances correct: False
Sun Jul 23 17:33:15 2017	INFO : Modelling...
Sun Jul 23 18:08:21 2017	INFO : Model 2 built
Sun Jul 23 18:08:21 2017	INFO : 3 gaps will be remodelled
Sun Jul 23 18:37:13 2017	INFO : Validating Calpha distances...
Sun Jul 23 18:37:13 2017	INFO : Model 2 distances correct: False
Sun Jul 23 18:37:13 2017	INFO : Modelling...
Sun Jul 23 19:15:50 2017	INFO : Model 3 built
Sun Jul 23 19:15:50 2017	INFO : 3 gaps will be remodelled
Sun Jul 23 19:44:29 2017	INFO : Validating Calpha distances...
Sun Jul 23 19:44:29 2017	INFO : Model 3 distances correct: False
Sun Jul 23 19:44:29 2017	INFO : Modelling...
Sun Jul 23 20:22:14 2017	INFO : Model 4 built
Sun Jul 23 20:22:14 2017	INFO : 3 gaps will be remodelled
Sun Jul 23 20:53:47 2017	INFO : Validating Calpha distances...
Sun Jul 23 20:53:47 2017	INFO : Model 4 distances correct: False
Sun Jul 23 20:53:47 2017	INFO : Modelling...
Sun Jul 23 21:29:33 2017	INFO : Model 5 built
Sun Jul 23 21:29:33 2017	INFO : 3 gaps will be remodelled
Sun Jul 23 21:58:47 2017	INFO : Validating Calpha distances...
Sun Jul 23 21:58:47 2017	INFO : Model 5 distances correct: False
Sun Jul 23 21:58:47 2017	INFO : None of the models passed the CA-distance validation
Sun Jul 23 21:58:47 2017	ERROR : Modelling already was de novo, finishing with error
Sun Jul 23 21:58:47 2017	STATUS CHANGED : R -> E
Mon Jul 24 16:54:02 2017	STATUS CHANGED : N -> R
Mon Jul 24 16:54:02 2017	INFO : JOB STARTED AT: 2017-07-24 16:54:02.089066
Mon Jul 24 16:54:02 2017	INFO : METHOD: 1
Mon Jul 24 16:54:02 2017	INFO : Precalculated profile found...
Mon Jul 24 16:54:02 2017	INFO : Homologue pool found...
Mon Jul 24 16:54:02 2017	INFO : Verifying structure sequences of homologues...
Mon Jul 24 16:57:05 2017	INFO : Starting homologue filtering...
Mon Jul 24 16:57:45 2017	INFO : Getting structures from PDB...
Mon Jul 24 16:57:53 2017	INFO : Creating modelling alignment...
Mon Jul 24 16:57:53 2017	INFO : Modelling...
Mon Jul 24 17:23:39 2017	INFO : Model 1 built
Mon Jul 24 17:23:39 2017	INFO : 3 gaps will be remodelled
Mon Jul 24 18:47:36 2017	INFO : Validating Calpha distances...
Mon Jul 24 18:47:36 2017	INFO : Model 1 distances correct: False
Mon Jul 24 18:47:36 2017	INFO : Modelling...
Mon Jul 24 19:13:56 2017	INFO : Model 2 built
Mon Jul 24 19:13:56 2017	INFO : 3 gaps will be remodelled
Mon Jul 24 20:23:09 2017	INFO : Validating Calpha distances...
Mon Jul 24 20:23:09 2017	INFO : Model 2 distances correct: False
Mon Jul 24 20:23:09 2017	INFO : Modelling...
Mon Jul 24 20:50:03 2017	INFO : Model 3 built
Mon Jul 24 20:50:03 2017	INFO : 3 gaps will be remodelled
Mon Jul 24 22:30:26 2017	INFO : Validating Calpha distances...
Mon Jul 24 22:30:26 2017	INFO : Model 3 distances correct: False
Mon Jul 24 22:30:26 2017	INFO : Modelling...
Mon Jul 24 22:56:27 2017	INFO : Model 4 built
Mon Jul 24 22:56:27 2017	INFO : 2 gaps will be remodelled
Mon Jul 24 23:58:21 2017	INFO : Validating Calpha distances...
Mon Jul 24 23:58:21 2017	INFO : Model 4 distances correct: False
Mon Jul 24 23:58:21 2017	INFO : Modelling...
Tue Jul 25 00:24:02 2017	INFO : Model 5 built
Tue Jul 25 00:24:02 2017	INFO : 3 gaps will be remodelled
Tue Jul 25 02:02:33 2017	INFO : Validating Calpha distances...
Tue Jul 25 02:02:33 2017	INFO : Model 5 distances correct: False
Tue Jul 25 02:02:33 2017	INFO : None of the models passed the CA-distance validation
Tue Jul 25 02:02:33 2017	ERROR : Modelling already was de novo, finishing with error
Tue Jul 25 02:02:33 2017	STATUS CHANGED : R -> E
Tue Jul 25 10:07:01 2017	STATUS CHANGED : N -> R
Tue Jul 25 10:07:01 2017	INFO : JOB STARTED AT: 2017-07-25 10:07:01.975753
Tue Jul 25 10:07:01 2017	INFO : METHOD: 1
Tue Jul 25 10:07:02 2017	INFO : Precalculated profile found...
Tue Jul 25 10:07:02 2017	INFO : Homologue pool found...
Tue Jul 25 10:07:02 2017	INFO : Verifying structure sequences of homologues...
Tue Jul 25 10:10:14 2017	INFO : Starting homologue filtering...
Tue Jul 25 10:10:54 2017	INFO : Getting structures from PDB...
Tue Jul 25 10:11:01 2017	INFO : Creating modelling alignment...
Tue Jul 25 10:11:01 2017	INFO : Modelling...
Tue Jul 25 10:36:07 2017	INFO : Model 1 built
Tue Jul 25 10:36:07 2017	INFO : 3/3 gaps will be remodelled
Tue Jul 25 11:20:14 2017	INFO : Validating Calpha distances...
Tue Jul 25 11:20:14 2017	INFO : Model 1 distances correct: False
Tue Jul 25 11:20:14 2017	INFO : Modelling...
Tue Jul 25 11:45:55 2017	INFO : Model 2 built
Tue Jul 25 11:45:55 2017	INFO : 3/3 gaps will be remodelled
Tue Jul 25 12:24:25 2017	INFO : Validating Calpha distances...
Tue Jul 25 12:24:25 2017	INFO : Model 2 distances correct: False
Tue Jul 25 12:24:25 2017	INFO : Modelling...
Tue Jul 25 12:49:16 2017	INFO : Model 3 built
Tue Jul 25 12:49:16 2017	INFO : 3/3 gaps will be remodelled
Tue Jul 25 13:34:32 2017	INFO : Validating Calpha distances...
Tue Jul 25 13:34:32 2017	INFO : Model 3 distances correct: False
Tue Jul 25 13:34:32 2017	INFO : Modelling...
Tue Jul 25 14:00:08 2017	INFO : Model 4 built
Tue Jul 25 14:00:08 2017	INFO : 3/3 gaps will be remodelled
Tue Jul 25 14:45:02 2017	INFO : Validating Calpha distances...
Tue Jul 25 14:45:02 2017	INFO : Model 4 distances correct: False
Tue Jul 25 14:45:02 2017	INFO : Modelling...
Tue Jul 25 15:09:56 2017	INFO : Model 5 built
Tue Jul 25 15:09:56 2017	INFO : 3/3 gaps will be remodelled
Tue Jul 25 15:57:36 2017	INFO : Validating Calpha distances...
Tue Jul 25 15:57:36 2017	INFO : Model 5 distances correct: False
Tue Jul 25 15:57:36 2017	INFO : None of the models passed the CA-distance validation
Tue Jul 25 15:57:36 2017	STATUS CHANGED : R -> E
Tue Jul 25 15:57:36 2017	ERROR : Error while modelling
Tue Jul 25 16:37:01 2017	STATUS CHANGED : N -> R
Tue Jul 25 16:37:01 2017	INFO : JOB STARTED AT: 2017-07-25 16:37:01.719681
Tue Jul 25 16:37:01 2017	INFO : METHOD: 1
Tue Jul 25 16:37:01 2017	INFO : Precalculated profile found...
Tue Jul 25 16:37:01 2017	INFO : Homologue pool found...
Tue Jul 25 16:37:01 2017	INFO : Verifying structure sequences of homologues...
Tue Jul 25 16:40:21 2017	INFO : Starting homologue filtering...
Tue Jul 25 16:41:04 2017	INFO : Getting structures from PDB...
Tue Jul 25 16:41:12 2017	INFO : Creating modelling alignment...
Tue Jul 25 16:41:12 2017	INFO : Modelling...
Tue Jul 25 17:07:22 2017	INFO : Model 1 built
Tue Jul 25 17:07:22 2017	INFO : Validating Calpha distances...
Tue Jul 25 17:07:22 2017	INFO : Model 1 distances correct: False
Tue Jul 25 17:07:22 2017	INFO : Modelling...
Tue Jul 25 17:32:09 2017	INFO : Model 2 built
Tue Jul 25 17:32:09 2017	INFO : Validating Calpha distances...
Tue Jul 25 17:32:09 2017	INFO : Model 2 distances correct: False
Tue Jul 25 17:32:09 2017	INFO : Modelling...
Tue Jul 25 17:57:34 2017	INFO : Model 3 built
Tue Jul 25 17:57:34 2017	INFO : Validating Calpha distances...
Tue Jul 25 17:57:34 2017	INFO : Model 3 distances correct: False
Tue Jul 25 17:57:34 2017	INFO : Modelling...
Tue Jul 25 18:23:10 2017	INFO : Model 4 built
Tue Jul 25 18:23:10 2017	INFO : Validating Calpha distances...
Tue Jul 25 18:23:10 2017	INFO : Model 4 distances correct: True
Tue Jul 25 18:23:10 2017	INFO : Modelling...
Tue Jul 25 18:48:25 2017	INFO : Model 5 built
Tue Jul 25 18:48:25 2017	INFO : Validating Calpha distances...
Tue Jul 25 18:48:25 2017	INFO : Model 5 distances correct: False
Tue Jul 25 18:48:33 2017	INFO : Finished modelling
Tue Jul 25 18:48:33 2017	STATUS CHANGED : R -> P
Tue Jul 25 18:48:33 2017	INFO : Checking topology...
Tue Jul 25 19:20:18 2017	INFO : Knot matrices done...
Tue Jul 25 19:21:03 2017	INFO : Some knots found!
Tue Jul 25 19:21:10 2017	INFO : Some lassos found!
Tue Jul 25 19:21:10 2017	INFO : Finishing...
Tue Jul 25 19:21:10 2017	INFO : Job done
Tue Jul 25 19:21:10 2017	STATUS CHANGED : P -> F
Tue Jul 25 19:21:10 2017	STATUS CHANGED : F -> F

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