Structure of PDB 7rh5 Chain M Binding Site BS05

Receptor Information

>7rh5 Chain M (length=382) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

GQPTDAELAEMSREELVKLGGKIDGVETIFKEPRWPVPGTKAEKRTERLV
AYWLMLGGLSGLALLLVFLFWPWEYQPFGSEGEFLYSLATPLYGLTFGLS
ILSIGIGAVLFQKKFIPEEISVQDRHDGRSPEVHRKTVAANLTDALEGST
LKRRKVIGLSLGIGLGAFGAGTLVAFIGGLIKNPWKPVVPTAEGKKAVLW
TSGWTPRFKGETIYLARATGRPGESPFVKMRPEDIDAGGMETVFPWRESD
GDGTTVESEHKLTEIAMGVRNPVMLIRIKPADMHRVIKRKGQESFNFGEL
FAYTKVCSHLGCPSSLYEQQTYRILCPCHQSQFDALEFAKPIFGPAARAL
AQLPITIDEDGYLVANGDFVEPVGPAFWERKS

Ligand information

InChI=1S/2Fe.2S

NIXDOXVAJZFRNF-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04	[Fe]1S[Fe]S1
CACTVS 3.341 OpenEye OEToolkits 1.5.0	S1[Fe]S[Fe]1

Formula

Fe2 S2

Name

FE2/S2 (INORGANIC) CLUSTER

ChEMBL

DrugBank

ZINC

PDB chain

7rh5 Chain M Residue 503 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	7rh5 Structure of mycobacterial CIII 2 CIV 2 respiratory supercomplex bound to the tuberculosis drug candidate telacebec (Q203).
Resolution	3.0 Å
Binding residue (original residue number in PDB)	C346 H348 C351 C365 H368
Binding residue (residue number reindexed from 1)	C307 H309 C312 C326 H329
Annotation score	4

Enzymatic activity

Enzyme Commision number

Gene Ontology

	Molecular Function
GO:0016491	oxidoreductase activity
GO:0046872	metal ion binding
GO:0051537	2 iron, 2 sulfur cluster binding

	Cellular Component
GO:0005886	plasma membrane

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Molecular Function

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Cellular Component

External links

PDB	RCSB:7rh5, PDBe:7rh5, PDBj:7rh5
PDBsum	7rh5
PubMed	34590581
UniProt	I7GD61

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