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BMRB: 19153

2M6T

NMR solution structure ensemble of 3-4D mutant domain 11 IGF2R

Authors

Strickland, M., Williams, C., Richards, E., Minnall, L., Crump, M.P., Frago, S., Hughes, J., Garner, L., Hoppe, H., Rezgui, D., Zaccheo, O.J., Prince, S.N., Hassan, A.B., Whittaker, S.

Assembly

IGF2R

Entity

1. IGF2R (polymer, Thiol state: all disulfide bound), 142 monomers, 15416.43 Da Detail

MKSNEHDDCQ VTNPSTGHLF DLSSLSGRAG FTAAYAKGWG VYMSICGENE NCPPGVGACF GQTRISVGKA NKRLRYVDQV LQLVYKDGSP CPSKSGLSYK SVISFVCRPE AGPTNRPMLI SLDKQTCTLF FSWHTPLACE LA

Formula weight

15416.43 Da

Entity Connection

disulfide 4 Detail

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS9:SG	1:CYS46:SG
2	disulfide	sing	1:CYS52:SG	1:CYS59:SG
3	disulfide	sing	1:CYS91:SG	1:CYS127:SG
4	disulfide	sing	1:CYS107:SG	1:CYS139:SG

Source organism

Homo sapiens

Exptl. method

solution NMR

Refine. method

DGSA-distance geometry simulated annealing

Data set

assigned_chemical_shifts, heteronucl_NOEs, heteronucl_T1_relaxation, heteronucl_T2_relaxation

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 97.4 %, Completeness (bb): 98.8 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	97.4 % (1555 of 1596)	98.1 % (811 of 827)	96.1 % (599 of 623)	99.3 % (145 of 146)
Backbone	98.8 % (824 of 834)	99.7 % (287 of 288)	98.1 % (405 of 413)	99.2 % (132 of 133)
Sidechain	96.5 % (860 of 891)	97.2 % (524 of 539)	95.3 % (323 of 339)	100.0 % (13 of 13)
Aromatic	86.0 % (117 of 136)	95.6 % (65 of 68)	75.8 % (50 of 66)	100.0 % (2 of 2)
Methyl	100.0 % (134 of 134)	100.0 % (67 of 67)	100.0 % (67 of 67)

1. IGF2R

MKSNEHDDCQ VTNPSTGHLF DLSSLSGRAG FTAAYAKGWG VYMSICGENE NCPPGVGACF GQTRISVGKA NKRLRYVDQV LQLVYKDGSP CPSKSGLSYK SVISFVCRPE AGPTNRPMLI SLDKQTCTLF FSWHTPLACE LA

Show sample condition

Sample #1

Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

Sample #2

Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.19 ppm, Outliers: 1 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.19 ppm, Outliers: 1 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: 0.16 ppm, Outliers: 1 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.16 ppm, Outliers: 2 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2M6T, Strand ID: A Detail

Heteronucl. T₁

284 T₁ values in 2 lists
Coherence na, Field strength (¹H) 600 MHz, 900 MHz, Pressure 1 atm, Temperature 273 K, pH 5.5 Detail

Heteronucl. T₂

284 T₂ values in 2 lists
Coherence na, Field strength (¹H) 600 MHz, 900 MHz, Pressure 1 atm, Temperature 273 K, pH 5.5 Detail

Heteronucl. NOE

266 NOE values in 2 lists
Value type peak height, Field strength (¹H) 600 MHz, 900 MHz, Pressure 1 atm, Temperature 273 K, pH 5.5 Detail

Heteronucl. T₁/T₂

284 T₁/T₂ values in 2 lists
Field strength (¹H) 600 MHz, 900 MHz, Pressure 1 atm, Temperature 273 K, pH 5.5 Detail

Release date

2014-10-12

Citation

Directed evolution of structurally selected IGF2R domain 11 binding loop residues generates an IGF2 super-antagonist
Frago, S., Strickland, M., Hughes, J., Williams, C., Garner, L., Hoppe, H., Rezgui, D., Zaccheo, O.J., Prince, S.N., Crump, M.P., Hassan, A.B.
EMBO J.

Related entities 1. IGF2R, : 1 : 1 : 122 entities Detail

Interaction partners 1. IGF2R, : 39 interactors Detail

More details for 39 interactors identified by 15 citations

Experiments performed 19 experiments Detail

1 2D 1H-15N HSQC

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

2 2D 1H-13C HSQC

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

3 3D CBCA(CO)NH

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

4 3D C(CO)NH

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

5 3D HNCO

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

6 3D HNCA

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

7 3D HN(CO)CA

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

8 3D H(CCO)NH

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

9 3D HCCH-TOCSY

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

10 3D 1H-15N NOESY

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

11 3D 1H-15N TOCSY

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

12 3D 1H-13C NOESY aliphatic

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

13 Heteronuclear NOE ratio

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

14 Heteronuclear NOE ratio

Instrument

Varian VNMRS - 900 MHz Fitted with a cryogenically cooled probehead. HWB-NMR/Welcome Trust.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

15 T1 experiments

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

16 T1 experiments

Instrument

Varian VNMRS - 900 MHz Fitted with a cryogenically cooled probehead. HWB-NMR/Welcome Trust.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

17 T2 experiments

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

18 T2 experiments

Instrument

Varian VNMRS - 900 MHz Fitted with a cryogenically cooled probehead. HWB-NMR/Welcome Trust.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details DYNAMICS STUDIES

#	Name	Isotope labeling	Concentration
7	IGF2R	[U-95% 15N]	1 mM
8	D2O	[U-2H]	7 %
9	H2O	natural abundance	93 %
10	sodium azide	natural abundance	100 uM
11	EDTA	natural abundance	1 mM
12	sodium acetate	natural abundance	10 mM

19 3D 1H-13C NOESY aromatic

Instrument

Varian VNMRS - 600 MHz Fitted with a cryogenically cooled probehead. Bristol University.

Sample

State isotropic, Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5, Details STRUCTURAL STUDIES

#	Name	Isotope labeling	Concentration
1	IGF2R	[U-95% 13C; U-95% 15N]	1 mM
2	D2O	[U-2H]	7 %
3	H2O	natural abundance	93 %
4	sodium azide	natural abundance	100 uM
5	EDTA	natural abundance	1 mM
6	sodium acetate	natural abundance	10 mM

NMR combined restraints 6 contents Detail

Properties

Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints	combined_19153_2m6t.nef
Input source #2: Coordindates	2m6t.cif
Diamagnetism of the molecular assembly	True (excluding Oxygen atoms)
Whether the assembly has a disulfide bond	True (see coordinates for details)
Whether the assembly has a other bond	None
Whether the assembly contains a cyclic polymer	None
Overall data processing status	Warning

Disulfide bonds

Ptnr_site_1	Ptnr_site_2	Redox_state_prediction_1	Redox_state_prediction_2	Distance (Å)
A:1516:CYS:SG	A:1553:CYS:SG	oxidized, CA 58.373, CB 41.473 ppm	oxidized, CA 56.794, CB 41.432 ppm	2.018
A:1559:CYS:SG	A:1566:CYS:SG	oxidized, CA 50.757, CB 39.39 ppm	oxidized, CA 55.785, CB 42.961 ppm	2.02
A:1598:CYS:SG	A:1634:CYS:SG	oxidized, CA 52.203, CB 42.735 ppm	oxidized, CA 59.011, CB 40.718 ppm	2.029
A:1614:CYS:SG	A:1646:CYS:SG	oxidized, CA 57.282, CB 39.003 ppm	oxidized, CA 54.518, CB 42.732 ppm	2.025

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

None

Non-standard residues

None

Sequence alignments

Entity_assembly_ID (NMR): A vs Auth_asym_ID (model): A

--1510---1520------1530------1540------1550------1560------1570------1580------1590------1600------1
MKSNEHDDCQVTNPSTGHLFDLSSLSGRAGFTAAYAKGWGVYMSICGENENCPPGVGACFGQTRISVGKANKRLRYVDQVLQLVYKDGSPCPSKSGLSYK
||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
MKSNEHDDCQVTNPSTGHLFDLSSLSGRAGFTAAYAKGWGVYMSICGENENCPPGVGACFGQTRISVGKANKRLRYVDQVLQLVYKDGSPCPSKSGLSYK
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100

610------1620------1630------1640---------
SVISFVCRPEAGPTNRPMLISLDKQTCTLFFSWHTPLACELA
||||||||||||||||||||||||||||||||||||||||||
SVISFVCRPEAGPTNRPMLISLDKQTCTLFFSWHTPLACELA
-------110-------120-------130-------140--

Chain assignments

Entity_assembly_ID (NMR)	Auth_asym_ID (model)	Length	Unmapped	Conflict	Sequence coverage (%)
A	A	142	0	0	100.0

Content subtype: combined_19153_2m6t.nef

#	Content subtype	Saveframe	Status	# of rows (sets)	Experiment type	Sequence coverage (%)
1	Covalent bonds	assembly	OK	4		No information
1	Assigned chemical shifts	assigned_chem_shift_list_1	Warning	1563		100.0 (chain: A, length: 142)
1	Distance restraints	CNS/XPLOR_distance_constraints_2	OK	212 (1)	noe	66.9 (chain: A, length: 142)
2	Distance restraints	CNS/XPLOR_distance_constraints_5	Warning	2197 (1)	noe	99.3 (chain: A, length: 142)
3	Distance restraints	CNS/XPLOR_distance_constraints_3	Warning	50 (1)	hbond	19.7 (chain: A, length: 142)
1	Dihedral angle restraints	CNS/XPLOR_dihedral_4	OK	211 (211)	.	95.1 (chain: A, length: 142)

Assigned chemical shifts

Saveframe: assigned_chem_shift_list_1
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 142, Sequence coverage: 100.0%
- Total number of assignments
  - ¹H chemical shifts: 815
  - ¹³C chemical shifts: 597
  - ¹⁵N chemical shifts: 151
- Completeness of assignments
  - Entity_assemble_ID: A
- Redox state of CYS
- Peptide bond of PRO
- Rotameric state of ILE , LEU, and VAL
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: A

Comp_index_ID	Comp_ID	Atom_ID	CS value (ppm)
1513	HIS	HE2	7.021
1522	SER	HG	5.191
1573	SER	HG	5.803
1592	TYR	HH	9.922

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	827	811	98.1
¹³C chemical shifts	623	597	95.8
¹⁵N chemical shifts	152	151	99.3

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	288	287	99.7
¹³C chemical shifts	284	274	96.5
¹⁵N chemical shifts	133	132	99.2

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	539	524	97.2
¹³C chemical shifts	339	323	95.3
¹⁵N chemical shifts	19	19	100.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	70	70	100.0
¹³C chemical shifts	70	70	100.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	68	65	95.6
¹³C chemical shifts	66	50	75.8
¹⁵N chemical shifts	2	2	100.0

Covalent bonds

Saveframe: assembly
- Status: OK

Distance restraints

Saveframe: CNS/XPLOR_distance_constraints_2
- Status: OK
- Experiment type: noe
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 142, Sequence coverage: 66.9%
- Total number of restraints: 212
- Weight of restraints: 1.0 (212)
- Potential type of restraints: square-well-parabolic (212)
- Range of distance target values: 1.8, 5.5 (Å)
- Histogram of distance target values
- Histogram of discrepancy in distance target values
- Distance restraints per residue
  - Chain_ID: A
- Distance restraints on contact map
- Saveframe: CNS/XPLOR_distance_constraints_5
  - Status: Warning
  - Experiment type: noe
  - Sequence coverage of experimental data
    - Entity_assembly_ID: A, Chain length: 142, Sequence coverage: 99.3%
  - Total number of restraints: 2197
  - Weight of restraints: 1.0 (2197)
  - Potential type of restraints: lower-bound-parabolic (2), square-well-parabolic (2195)
  - Range of distance target values: 1.72, 5.94 (Å)
  - Histogram of distance target values
  - Histogram of discrepancy in distance target values
  - Distance restraints per residue
    - Chain_ID: A
  - Distance restraints on contact map
  - Saveframe: CNS/XPLOR_distance_constraints_3
    - Status: Warning
    - Experiment type: hbond
    - Sequence coverage of experimental data
      - Entity_assembly_ID: A, Chain length: 142, Sequence coverage: 19.7%
    - Total number of restraints: 50
    - Weight of restraints: 1.0 (50)
    - Potential type of restraints: square-well-parabolic (50)
    - Range of distance target values: 2.0, 3.12 (Å)
    - Histogram of distance target values
    - Distance restraints per residue
      - Chain_ID: A
    - Distance restraints on contact map

Dihedral angle restraints

Saveframe: CNS/XPLOR_dihedral_4
- Status: OK
- Experiment type: .
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 142, Sequence coverage: 95.1%
- Total number of restraints: 211
- Total number of restraints per polymer type: 211
- Weight of restraints: 1.0 (211)
- Potential type of restraints: square-well-parabolic (211)
- Plot of Phi-Psi angle restraints
- Dihedral angle restraints per residue
  - Chain_ID: A

Keywords 3-4D, Domain 11, IGF2, IGF2R, Mutant, NMR, Solution

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BMRB: 19153

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Chemical shift reference

Chemical shift reference

Chemical shift reference

Chemical shift reference

Related entities 1. IGF2R, : 1 : 1 : 122 entities Detail

Interaction partners 1. IGF2R, : 39 interactors Detail

Experiments performed 19 experiments Detail

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NMR combined restraints 6 contents Detail