Structure of PDB 8pau Chain A

Receptor sequence

>8pauA (length=276) Species: 9606 (Homo sapiens) [Search protein sequence]

DIFNRDPRDHYDLLQRLGGGTYGEVFKARDKVSGDLVALKMVKMEPDDDV
STLQKEILILKTCRHANIVAYHGSYLWLQKLWICMEFCGAGSLQDIYQVT
GSLSELQISYVCREVLQGLAYLHSQKKIHRDIKGANILINDAGEVRLADF
GLSFIGTPYWMAPEVAAVALKGGYNELCDIWSLGITAIELAELQPPLFDV
HPLRVLFLMTKSGYQPPRLKEKGKWSAAFHNFIKVTLTKSPKKRPSATKM
LSHQLVSQPGLNRGLILDLLDKLKNP

3D structure

PDB

8pau Identification and optimization of Azaindole based MAP4K1 Inhibitors and the discovery of BAY-405

Chain

Resolution

2.8 Å

3D
structure

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Interaction with ligand

Site #	Ligand	Ligand chain	Binding residues on receptor (original residue number in PDB)	Binding residues on receptor (residue number reindexed from 1)	Binding affinity
BS01	XOR	A	L23 G24 G25 G26 Y28 V31 A44 M91 C94 D101 L144	L17 G18 G19 G20 Y22 V25 A38 M85 C88 D95 L138

External links

PDB	RCSB:8pau, PDBe:8pau, PDBj:8pau
PDBsum	8pau
PubMed
UniProt	Q92918\|M4K1_HUMAN Mitogen-activated protein kinase kinase kinase kinase 1 (Gene Name=MAP4K1)

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