BMRB Entry 1702

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR1702

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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:

Positioning of a Spin-Labeled Substrate Analogue into the Structure of delta5-3-Ketosteroid Isomerase by Combined Kinetic, Magnetic Resonance, and X-ray Diffraction Methods

Deposition date:

1995-07-31

Original release date:

1999-06-14

Authors:

Kuliopulos, Anthan; Westbrook, Edwin; Talalay, Paul; Mildvan, Albert

Citation:

Citation: Kuliopulos, Anthan; Westbrook, Edwin; Talalay, Paul; Mildvan, Albert. "Positioning of a Spin-Labeled Substrate Analogue into the Structure of delta5-3-Ketosteroid Isomerase by Combined Kinetic, Magnetic Resonance, and X-ray Diffraction Methods" Biochemistry 26, 3927-3937 (1987).

Assembly members:

Assembly members:
delta5-3-ketosteroid isomerase, polymer, 125 residues, Formula weight is not available

Natural source:

Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available

Experimental source:

Experimental source: Production method: not available

Entity Sequences (FASTA):

Entity Sequences (FASTA):
delta5-3-ketosteroid isomerase: MNTPEHMTAVVQRYVAALNA GNLNGIVALFADNATVEDPV GSEPRSGTAAIREFYANSLK LPLAVELTQEVRAVANQAAF AFTVSFEYQGRKTVVAPIDH FRFNGAGKVVSMRALFGEKN IHAGA

Data sets:

assigned_chemical_shifts
- chemical_shift_assignment_data_set_one

Data type	Count
1H chemical shifts	32

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	delta5-3-ketosteroid isomerase	1

Entities:

Entity 1, delta5-3-ketosteroid isomerase 125 residues - Formula weight is not available

1

MET

ASN

THR

PRO

GLU

HIS

MET

THR

ALA

VAL

2

VAL

GLN

ARG

TYR

VAL

ALA

LEU

ASN

ALA

3

GLY

ASN

LEU

ASN

GLY

ILE

VAL

ALA

LEU

PHE

4

ALA

ASP

ASN

ALA

THR

VAL

GLU

ASP

PRO

VAL

5

GLY

SER

GLU

PRO

ARG

SER

GLY

THR

ALA

6

ILE

ARG

GLU

PHE

TYR

ALA

ASN

SER

LEU

LYS

7

LEU

PRO

LEU

ALA

VAL

GLU

LEU

THR

GLN

GLU

8

VAL

ARG

ALA

VAL

ALA

ASN

GLN

ALA

PHE

9

ALA

PHE

THR

VAL

SER

PHE

GLU

TYR

GLN

GLY

10

ARG

LYS

THR

VAL

ALA

PRO

ILE

ASP

HIS

11

PHE

ARG

PHE

ASN

GLY

ALA

GLY

LYS

VAL

12

SER

MET

ARG

ALA

LEU

PHE

GLY

GLU

LYS

ASN

13

ILE

HIS

ALA

GLY

ALA

Samples:

sample_one:

sample_condition_set_one: pH: 6.8 na; temperature: 297 K

Experiments:

Name	Sample	Sample state	Sample conditions

Software:

No software information available

NMR spectrometers:

unknown unknown 0 MHz