CASP8andFADD-likeapoptosisregulator / Caspase homolog / CASH / Caspase-eight-related protein / Casper / Caspase-like apoptosis regulatory ...Caspase homolog / CASH / Caspase-eight-related protein / Casper / Caspase-like apoptosis regulatory protein / CLARP / Cellular FLICE-like inhibitory protein / c-FLIP / FADD-like antiapoptotic molecule 1 / FLAME-1 / Inhibitor of FLICE / I-FLICE / MACH-related inducer of toxicity / MRIT / Usurpin
Mass: 21588.219 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Homo sapiens (human) / Gene: CFLAR, CASH, CASP8AP1, CLARP, MRIT / Production host: Escherichia coli (E. coli) / References: UniProt: O15519
#2: Protein/peptide
C8-H1a
Mass: 1030.071 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Homo sapiens (human) / Production host: Escherichia coli (E. coli)
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Experimental details
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Experiment
Experiment
Method: SOLUTION NMR
NMR experiment
Conditions-ID
Experiment-ID
Solution-ID
Sample state
Spectrometer-ID
Type
1
1
2
isotropic
1
2D 1H-15N HSQC
1
2
1
isotropic
1
2D 1H-13C HSQC
1
3
1
isotropic
1
2D 1H-1H TOCSY
1
4
2
isotropic
1
3D 1H-15N NOESY
1
5
2
isotropic
1
3D 1H-13C NOESY
1
17
2
isotropic
1
3D 1H-15N Filtered NOESY
1
16
2
isotropic
1
3D 1H-13C Filttered NOESY
2
15
3
isotropic
2
2D 1H-15N HSQC
2
14
3
isotropic
2
2D 1H-13C HSQC
2
13
3
isotropic
2
3D HNCO
2
12
3
isotropic
2
3D HN(CA)CB
2
11
3
isotropic
3
3DCBCA(CO)NH
2
10
3
isotropic
3
3DHBHA(CO)NH
2
9
3
isotropic
2
3D (H)CCH-TOCSY
2
8
3
isotropic
2
3D CCH-TOCSY
2
7
3
isotropic
2
3D HNCA
2
6
3
isotropic
2
3D 1H-15N NOESY
2
18
3
isotropic
2
3D 1H-13C NOESY
1
19
2
isotropic
1
2D 1H-1H Fltered NOESY
1
20
2
isotropic
1
2D 1H-1H Filtered TOCSY
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Sample preparation
Details
Type
Solution-ID
Contents
Label
Solvent system
solution
1
10 mM C8-H1a, 0.002 % v/v sodium azide, 110 mM sodium phosphate, 95% H2O/5% D2O
C8-H1a
95% H2O/5% D2O
solution
2
04 mM C8-H1a, 0.002 % v/v sodium azide, 110 mM sodium phosphate, 0.6 mM [U-99% 13C; U-99% 15N] c-FLIPs, 95% H2O/5% D2O
c-FLIPs_C8-H1a
95% H2O/5% D2O
solution
3
0.002 % v/v sodium azide, 110 mM sodium phosphate, 0.6 mM [U-99% 13C; U-99% 15N] c-FLIPs, 1 mM TCEP, 1 mM EDTA, 95% H2O/5% D2O
c-FLIPs
95% H2O/5% D2O
Sample
Conc. (mg/ml)
Component
Isotopic labeling
Solution-ID
10mM
C8-H1a
naturalabundance
1
0.002 % v/v
sodiumazide
naturalabundance
1
110mM
sodiumphosphate
naturalabundance
1
04mM
C8-H1a
naturalabundance
2
0.002 % v/v
sodiumazide
naturalabundance
2
110mM
sodiumphosphate
naturalabundance
2
0.6mM
c-FLIPs
[U-99% 13C; U-99% 15N]
2
0.002 % v/v
sodiumazide
naturalabundance
3
110mM
sodiumphosphate
naturalabundance
3
0.6mM
c-FLIPs
[U-99% 13C; U-99% 15N]
3
1mM
TCEP
naturalabundance
3
1mM
EDTA
naturalabundance
3
Sample conditions
Conditions-ID
Ionic strength
Label
pH
Pressure (kPa)
Temperature (K)
1
110mM
condition_1
7.4
1Pa
298K
2
60mM
condition_2
7.4
1Pa
298K
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NMR measurement
NMR spectrometer
Type
Manufacturer
Model
Field strength (MHz)
Spectrometer-ID
Bruker 1
Bruker
1
700
1
Bruker 2
Bruker
2
800
2
Bruker 3
Bruker
3
600
3
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Processing
NMR software
Name
Developer
Classification
Sparky
Goddard
chemicalshiftassignment
X-PLOR NIH
Schwieters, Kuszewski, TjandraandClore
structurecalculation
Sparky
Goddard
peakpicking
TopSpin
BrukerBiospin
collection
Refinement
Method: simulated annealing / Software ordinal: 2
NMR representative
Selection criteria: lowest energy
NMR ensemble
Conformer selection criteria: structures with the lowest energy Conformers calculated total number: 200 / Conformers submitted total number: 10
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