BMRB Entry 6496

Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR6496

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Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

Backbone 1H and 15N Chemical Shift Assignments for Chorismate Mutase from Bacillus subtilis in complex with prephenate

Deposition date:

2005-02-08

Original release date:

2005-05-24

Authors:

Eletsky, Alexander; Kienhofer, Alexander; Hilvert, Donald; Pervushin, Konstantin

Citation:

Citation: Eletsky, Alexander; Kienhofer, Alexander; Hilvert, Donald; Pervushin, Konstantin. "Investigation of Ligand Binding and Protein Dynamics in Bacillus subtilis Chorismate Mutase by Transverse Relaxation Optimized Spectroscopy-Nuclear Magnetic Resonance" Biochemistry 44, 6788-6799 (2005).
PubMed: 15865424

Assembly members:

Assembly members:
BsCM, polymer, 127 residues, Formula weight is not available
PRE, non-polymer, 226.183 Da.

Natural source:

Natural source: Common Name: Bacillus subtilis Taxonomy ID: 1423 Superkingdom: Bacteria Kingdom: not available Genus/species: Bacillus subtilis

Experimental source:

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
BsCM: MMIRGIRGATTVERDTEEEI LQKTKQLLEKIIEENHTKPE DVVQMLLSATPDLHAVFPAK AVRELSGWQYVPVTCMQEMD VTGGLKKCIRVMMTVQTDVP QDQIRHVYLEKAVVLRPDLS LTKNTEL

Data sets:

assigned_chemical_shifts
- Backbone_chemical_shifts_of_BsCM_in_complex_with_prephenate

Data type	Count
1H chemical shifts	220
15N chemical shifts	118

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	BsCM polypeptide_A	1
2	BsCM polypeptide_B	1
3	BsCM polypeptide_C	1
4	prephenate_A	2
5	prephenate_B	2
6	prephenate_C	2

Entities:

Entity 1, BsCM polypeptide_A 127 residues - Formula weight is not available

1

MET

ILE

ARG

GLY

ILE

ARG

GLY

ALA

THR

2

THR

VAL

GLU

ARG

ASP

THR

GLU

ILE

3

LEU

GLN

LYS

THR

LYS

GLN

LEU

GLU

LYS

4

ILE

GLU

ASN

HIS

THR

LYS

PRO

GLU

5

ASP

VAL

GLN

MET

LEU

SER

ALA

THR

6

PRO

ASP

LEU

HIS

ALA

VAL

PHE

PRO

ALA

LYS

7

ALA

VAL

ARG

GLU

LEU

SER

GLY

TRP

GLN

TYR

8

VAL

PRO

VAL

THR

CYS

MET

GLN

GLU

MET

ASP

9

VAL

THR

GLY

LEU

LYS

CYS

ILE

ARG

10

VAL

MET

THR

VAL

GLN

THR

ASP

VAL

PRO

11

GLN

ASP

GLN

ILE

ARG

HIS

VAL

TYR

LEU

GLU

12

LYS

ALA

VAL

LEU

ARG

PRO

ASP

LEU

SER

13

LEU

THR

LYS

ASN

THR

GLU

LEU

Entity 2, prephenate_A - C10 H10 O6 - 226.183 Da.

1

PRE

Samples:

TL_BsCM: BsCM, [U-2H; U-13C; U-15N], mM; .

DL-BsCM: BsCM, [U-13C; U-15N; U-<35% 2H], mM; .

15N_BsCM_PRE: BsCM, [U-95% 15N], mM; .

conditions_1: pH: 7.5; temperature: 293 K

Experiments:

Name	Sample	Sample state	Sample conditions
NOESY-TROSY	not available	not available	conditions_1
TOCSY-TROSY	not available	not available	conditions_1

Software:

No software information available

NMR spectrometers:

. . . MHz

BMRB	6494 6495
PDB	1COM 1DBF 1FNJ 1FNK 2CHS 2CHT 3ZO8 3ZOP 3ZP4 3ZP7
DBJ	BAI85767 BAM52750 BAM58325 GAK79439
EMBL	CAB14185 CCU58771 CEI57484 CEJ77906
GB	AAA20861 AAA22249 ABN05305 ABN05308 ABN13175
REF	NP_390150 WP_003230594 WP_004398096 WP_004398675 WP_009967606
SP	P19080
AlphaFold	P19080