Structure of PDB 5tf9 Chain B Binding Site BS03

Receptor Information

>5tf9 Chain B (length=266) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

ELETKAVGMSNDGRFLKFDIEIGRGSFKTVYKGLDTETTVEVAWCELQDR
KLTKSERQRFKEEAEMLKGLQHPNIVRFYDSWESTVKGKKCIVLVTELMT
SGTLKTYLKRFKVMKIKVLRSWCRQILKGLQFLHTRTPPIIHRDLKCDNI
FITGPTGSVKIGDLGLATLKGTPEFMAPEMYAAAYDESVDVYAFGMCMLE
MATSEYPYSECQNAAQIYRRVTSGVKPASFDKVAIPEVKEIIEGCIRQNK
DERYSIKDLLNHAFFQ

Ligand information

Ligand ID

InChI

InChI=1S/Mn/q+2

InChIKey

WAEMQWOKJMHJLA-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Mn+2]
CACTVS 3.341	[Mn++]

Formula

Name

MANGANESE (II) ION

PDB chain

5tf9 Chain B Residue 503 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

Global view

Local view

Structure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]

PDB	5tf9 Discovery and Characterization of Allosteric WNK Kinase Inhibitors.
Resolution	2.5 Å
Binding residue (original residue number in PDB)	N354 D368
Binding residue (residue number reindexed from 1)	N149 D163
Annotation score	1

Enzymatic activity

Catalytic site (original residue number in PDB)	D349 K351 D353 N354 D368 K375 T386
Catalytic site (residue number reindexed from 1)	D144 K146 D148 N149 D163 K170 T172
Enzyme Commision number	2.7.11.1: non-specific serine/threonine protein kinase.

Gene Ontology

	Molecular Function
GO:0004672	protein kinase activity
GO:0005524	ATP binding

	Biological Process
GO:0006468	protein phosphorylation

View graph for
Molecular Function

View graph for
Biological Process

External links

PDB	RCSB:5tf9, PDBe:5tf9, PDBj:5tf9
PDBsum	5tf9
PubMed	27712055
UniProt	Q9H4A3\|WNK1_HUMAN Serine/threonine-protein kinase WNK1 (Gene Name=WNK1)

[Back to BioLiP]