The protease-resistant N-terminal domain of TIR-domain containing adaptor molecule-1, TICAM-1
GPHMACTGPS LPSAFDILGA AGQDKLLYLK HKLKTPRPGC QGQDLLHAMV LLKLGQETEA RISLEALKAD AVARLVARQW AGVDSTEDPE EPPDVSWAVA RLYHLLAEEK LCPASLRDVA YQEAVRTLSS RDDHRLGELQ DEARNRCGWD IAGDPGSIR
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 99.1 % (1762 of 1778) | 99.7 % (922 of 925) | 98.1 % (680 of 693) | 100.0 % (160 of 160) |
Backbone | 99.0 % (925 of 934) | 99.4 % (318 of 320) | 98.5 % (458 of 465) | 100.0 % (149 of 149) |
Sidechain | 99.3 % (984 of 991) | 99.8 % (604 of 605) | 98.4 % (369 of 375) | 100.0 % (11 of 11) |
Aromatic | 93.3 % (84 of 90) | 100.0 % (45 of 45) | 85.7 % (36 of 42) | 100.0 % (3 of 3) |
Methyl | 100.0 % (186 of 186) | 100.0 % (93 of 93) | 100.0 % (93 of 93) |
1. TICAM-1 NTD
GPHMACTGPS LPSAFDILGA AGQDKLLYLK HKLKTPRPGC QGQDLLHAMV LLKLGQETEA RISLEALKAD AVARLVARQW AGVDSTEDPE EPPDVSWAVA RLYHLLAEEK LCPASLRDVA YQEAVRTLSS RDDHRLGELQ DEARNRCGWD IAGDPGSIRSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Varian Unity INOVA - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | TICAM-1_NTD | [U-99% 13C; U-99% 15N] | 0.75 mM | |
2 | DTT | natural abundance | 3 mM | |
3 | sodium phosphate | natural abundance | 50 mM | |
4 | sodium azide | natural abundance | 1 mM | |
5 | DSS | natural abundance | 0.02 mg/mL | |
6 | H2O | natural abundance | 90 % | |
7 | D2O | natural abundance | 10 % |
Properties
Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints | combined_19106_2m63.nef |
Input source #2: Coordindates | 2m63.cif |
Diamagnetism of the molecular assembly | True (excluding Oxygen atoms) |
Whether the assembly has a disulfide bond | None |
Whether the assembly has a other bond | None |
Whether the assembly contains a cyclic polymer | None |
Overall data processing status | Warning |
Disulfide bonds
NoneOther bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)
NoneNon-standard residues
NoneSequence alignments
-----------10--------20--------30--------40--------50--------60--------70--------80--------90------- GPHMACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| GPHMACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 100-------110-------120-------130-------140-------150------ RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR -------110-------120-------130-------140-------150---------
Chain assignments
Entity_assembly_ID (NMR) | Auth_asym_ID (model) | Length | Unmapped | Conflict | Sequence coverage (%) |
---|---|---|---|---|---|
A | A | 159 | 0 | 0 | 100.0 |
Content subtype: combined_19106_2m63.nef
Assigned chemical shifts
-----------10--------20--------30--------40--------50--------60--------70--------80--------90------- GPHMACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| GPHMACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA 100-------110-------120-------130-------140-------150------ RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR
Comp_index_ID | Comp_ID | Atom_ID | CS value (ppm) |
---|---|---|---|
20 | GLN | CD | 179.755 |
34 | ARG | CZ | 159.86 |
38 | GLN | CD | 180.134 |
40 | GLN | CD | 179.075 |
53 | GLN | CD | 179.384 |
58 | ARG | HH12 | 6.907 |
58 | ARG | HH11 | 6.471 |
58 | ARG | HH22 | 6.907 |
58 | ARG | CZ | 159.478 |
71 | ARG | HH11 | 6.825 |
71 | ARG | HH12 | 6.929 |
71 | ARG | HH22 | 6.825 |
71 | ARG | CZ | 159.802 |
75 | ARG | HH12 | 6.959 |
75 | ARG | HH11 | 6.703 |
75 | ARG | HH22 | 6.959 |
75 | ARG | CZ | 159.581 |
76 | GLN | CD | 179.015 |
98 | ARG | HH11 | 6.422 |
98 | ARG | HH12 | 6.422 |
98 | ARG | CZ | 158.933 |
98 | ARG | NH1 | 72.517 |
114 | ARG | HH11 | 6.916 |
114 | ARG | HH12 | 6.916 |
114 | ARG | CZ | 160.419 |
114 | ARG | NH1 | 72.11 |
119 | GLN | CD | 179.782 |
123 | ARG | HH11 | 6.792 |
123 | ARG | HH12 | 6.792 |
123 | ARG | CZ | 159.591 |
128 | ARG | HH12 | 7.126 |
128 | ARG | HH11 | 6.398 |
128 | ARG | HH22 | 7.126 |
128 | ARG | CZ | 159.635 |
132 | ARG | HH12 | 7.669 |
132 | ARG | HH11 | 7.171 |
132 | ARG | HH22 | 7.669 |
132 | ARG | CZ | 160.478 |
132 | ARG | NH2 | 71.451 |
137 | GLN | CD | 178.891 |
141 | ARG | HH12 | 6.854 |
141 | ARG | HH11 | 6.607 |
141 | ARG | HH22 | 6.854 |
142 | ASN | CG | 176.13 |
143 | ARG | HH12 | 6.792 |
143 | ARG | HH11 | 6.688 |
143 | ARG | HH22 | 6.792 |
143 | ARG | CZ | 159.135 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 925 | 924 | 99.9 |
13C chemical shifts | 693 | 674 | 97.3 |
15N chemical shifts | 172 | 171 | 99.4 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 320 | 319 | 99.7 |
13C chemical shifts | 318 | 307 | 96.5 |
15N chemical shifts | 149 | 148 | 99.3 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 605 | 605 | 100.0 |
13C chemical shifts | 375 | 367 | 97.9 |
15N chemical shifts | 23 | 23 | 100.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 95 | 95 | 100.0 |
13C chemical shifts | 95 | 95 | 100.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 45 | 45 | 100.0 |
13C chemical shifts | 42 | 34 | 81.0 |
15N chemical shifts | 3 | 3 | 100.0 |
Distance restraints
-----------10--------20--------30--------40--------50--------60--------70--------80--------90------- GPHMACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| ...MACTGPSLPSAFDILGAAGQDKLLYLKHKLKTPRPGCQGQDLLHAMVLLKLGQETEARISLEALKADAVARLVARQWAGVDSTEDPEEPPDVSWAVA 100-------110-------120-------130-------140-------150------ RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| RLYHLLAEEKLCPASLRDVAYQEAVRTLSSRDDHRLGELQDEARNRCGWDIAGDPGSIR