Solution structure of the zinc fingers 3 and 4 of MBNL1
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 72.2 % (697 of 965) | 77.6 % (396 of 510) | 62.6 % (228 of 364) | 80.2 % (73 of 91) |
Backbone | 77.8 % (383 of 492) | 91.6 % (152 of 166) | 64.6 % (159 of 246) | 90.0 % (72 of 80) |
Sidechain | 69.8 % (386 of 553) | 70.9 % (244 of 344) | 71.2 % (141 of 198) | 9.1 % (1 of 11) |
Aromatic | 31.3 % (20 of 64) | 56.3 % (18 of 32) | 6.3 % (2 of 32) | |
Methyl | 93.8 % (60 of 64) | 93.8 % (30 of 32) | 93.8 % (30 of 32) |
1. Muscleblind-like protein 1
AQKLMRTDRL EVCREYQRGN CNRGENDCRF AHPADSTMID TNDNTVTVCM DYIKGRCSRE KCKYFHPPAH LQAKIKAAQY QVNSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | external | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | external | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | external | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | external | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | external | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | external | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | external | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | external | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | external | indirect | 0.1013291 |
Bruker Avance - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 900 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0, Details 0.4 mM [U-98% 13C; U-98% 15N] Zinc fingers 3 and 4 of MBNL1, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Zinc fingers 3 and 4 of MBNL1 | [U-98% 13C; U-98% 15N] | 0.4 mM | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % | |
4 | NaCl | natural abundance | 50 mM |
Properties
Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints | combined_30208_5u6l.nef |
Input source #2: Coordindates | 5u6l.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 | True (see coodinates for details) |
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)
Ptnr_site_1 | Ptnr_site_2 | Redox_state_prediction_1 | Redox_state_prediction_2 | Distance (Ã…) |
---|---|---|---|---|
1:13:CYS:SG | 2:1:ZN:ZN | unknown | unknown | n/a |
1:21:CYS:SG | 2:1:ZN:ZN | unknown | unknown | n/a |
1:28:CYS:SG | 2:1:ZN:ZN | unknown | unknown | n/a |
1:32:HIS:NE2 | 2:1:ZN:ZN | unknown | unknown | n/a |
1:49:CYS:SG | 2:2:ZN:ZN | unknown | unknown | n/a |
1:57:CYS:SG | 2:2:ZN:ZN | unknown | unknown | n/a |
1:62:CYS:SG | 2:2:ZN:ZN | unknown | unknown | n/a |
1:66:HIS:NE2 | 2:2:ZN:ZN | unknown | unknown | n/a |
Non-standard residues
Chain_ID | Seq_ID | Comp_ID | Chem_comp_name | Experimental evidences |
---|---|---|---|---|
B | 1 | ZN | ZINC ION | None |
B | 2 | ZN | ZINC ION | None |
Sequence alignments
-----180-------190-------200-------210-------220-------230-------240-------250----- AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN --------10--------20--------30--------40--------50--------60--------70--------80---
Chain assignments
Entity_assembly_ID (NMR) | Auth_asym_ID (model) | Length | Unmapped | Conflict | Sequence coverage (%) |
---|---|---|---|---|---|
A | A | 83 | 0 | 0 | 100.0 |
Content subtype: combined_30208_5u6l.nef
Assigned chemical shifts
-----180-------190-------200-------210-------220-------230-------240-------250----- AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 510 | 397 | 77.8 |
13C chemical shifts | 364 | 220 | 60.4 |
15N chemical shifts | 99 | 72 | 72.7 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 166 | 153 | 92.2 |
13C chemical shifts | 166 | 80 | 48.2 |
15N chemical shifts | 80 | 72 | 90.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 344 | 244 | 70.9 |
13C chemical shifts | 198 | 140 | 70.7 |
15N chemical shifts | 19 | 0 | 0.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 35 | 33 | 94.3 |
13C chemical shifts | 35 | 33 | 94.3 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 32 | 18 | 56.2 |
13C chemical shifts | 32 | 0 | 0.0 |
Covalent bonds
Distance restraints
-----180-------190-------200-------210-------220-------230-------240-------250----- AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN |||||||||||||||||||||||||||||||||| |||||||||||||||||||||||||||||| |||||||||| || ..KLMRTDRLEVCREYQRGNCNRGENDCRFAHPADS..IDTNDNTVTVCMDYIKGRCSREKCKYFHPP.HLQAKIKAAQ.QV -----180-------190-------200-------210-------220-------230-------240-------250----
Dihedral angle restraints
-----180-------190-------200-------210-------220-------230-------240-------250----- AQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVN ||||||||||||||||||||| |||||||||||||||||||||||||||||||| ||||||||||||||||||||||||| AQKLMRTDRLEVCREYQRGNC.RGENDCRFAHPADSTMIDTNDNTVTVCMDYIK...SREKCKYFHPPAHLQAKIKAAQYQV -----180-------190-------200-------210-------220-------230-------240-------250----