BMRB Entry 7093

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PDB ID: 2gtv
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR7093
MolProbity Validation Chart

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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:

Chemical shift assignment of monomeric chorimate mutase from methanococcus jannaschii in a complex with a transition state analog

Deposition date:

2006-05-02

Original release date:

2007-11-21

Authors:

Vogeli, Beat; Pervushin, Konstantin; Vamvaca, Katherina; Hilvert, Donald

Citation:

Citation: Pervushin, Konstantin; Vamvaca, Katherina; Vogeli, Beat; Hilvert, Donald. "Structure and dynamics of a molten globular enzyme" Nat. Struct. Mol. Biol. 14, 1202-1206 (2007).
PubMed: 17994104

Assembly members:

Assembly members:
monomeric chorismate mutase from methanococcus jannaschii, polymer, 104 residues, Formula weight is not available
TSA, non-polymer, 228.199 Da.

Natural source:

Natural source: Common Name: Methanococcus jannaschii Taxonomy ID: 2190 Superkingdom: Archaea Kingdom: not available Genus/species: Methanococcus jannaschii

Experimental source:

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
monomeric chorismate mutase from methanococcus jannaschii: MIEKLAEIRKKIDEIDNKIL KARWPWAEKLIAERNSLAKD VAEIKNQLGIPINDPEREKY IYDRIRKLCKEHNVDENIGI KIFQRLIEHNKALQKQYLEE TLEH

Data sets:

assigned_chemical_shifts
- chem_shift_list_1

Data type	Count
13C chemical shifts	279
15N chemical shifts	101
1H chemical shifts	619

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	mMjCM	1
2	TSA	2

Entities:

Entity 1, mMjCM 104 residues - Formula weight is not available

1

MET

ILE

GLU

LYS

LEU

ALA

GLU

ILE

ARG

LYS

2

LYS

ILE

ASP

GLU

ILE

ASP

ASN

LYS

ILE

LEU

3

LYS

ALA

ARG

TRP

PRO

TRP

ALA

GLU

LYS

LEU

4

ILE

ALA

GLU

ARG

ASN

SER

LEU

ALA

LYS

ASP

5

VAL

ALA

GLU

ILE

LYS

ASN

GLN

LEU

GLY

ILE

6

PRO

ILE

ASN

ASP

PRO

GLU

ARG

GLU

LYS

TYR

7

ILE

TYR

ASP

ARG

ILE

ARG

LYS

LEU

CYS

LYS

8

GLU

HIS

ASN

VAL

ASP

GLU

ASN

ILE

GLY

ILE

9

LYS

ILE

PHE

GLN

ARG

LEU

ILE

GLU

HIS

ASN

10

LYS

ALA

LEU

GLN

LYS

GLN

TYR

LEU

GLU

11

THR

LEU

GLU

HIS

Entity 2, TSA - C10 H12 O6 - 228.199 Da.

1

TSA

Samples:

sample_1: mMjCM in complex with TSA, [U-15N], 0.07 mM

sample_2: mMjCM in complex with TSA, [U-13C; U-15N], 0.6 mM

conditions_1: pH: 6.5; temperature: 293 K

Experiments:

Name	Sample	Sample state	Sample conditions
standard suite for NMR assignment procedure	not available	not available	conditions_1

Software:

No software information available

NMR spectrometers:

Bruker Avance 900 MHz
Bruker Avance 600 MHz