Structure of PDB 6sj2 Chain A Binding Site BS02

Receptor Information

>6sj2 Chain A (length=495) Species: 1470557 (Streptomyces sp. Tu 6176) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

AMGARLITGGTVYTADAQESVHARGAVLTVDDKVVAVGPAVEVEQAVQAL
DPAVRAELRRLDASRMMVLPGFVNAHWHEMFAMGFTMRGALRPPSDRADQ
VAFMGGGGDMHQISATFDRFDGLIEAMTEDEARAIAEYSMWIQLRGGVTT
LGDMGSLNRPLAMVEAARRLGMRFSASTWASDAVLAPDRSRFLRTRDADT
VLASFEALLGAVAADPTGRIRCRPNVSYVTNMTDELARGMAELVERHDLP
FATHVGALRNEADAMRAYHGETGVRRLAEAGLVDERLMAGHSAFLDDQEQ
KLMLAGRAHISHSPGKYGPSGESALTETGVVPALRRAGLDVSLSTDAAAL
PGAGIAETMRAAWQMYNEMSADQTEVLPTDALAMATRIAAKGLRWDDAVG
SLEPGKQADLLLVRTDDWRYLLNPRPLESFLWLAGSADVDTVIVGGRTLV
EGGRGVEVDEAALRDRYLQALRGFTTRALRVPAEAVDPVLAEVAR

Ligand information

Ligand ID

InChI

InChI=1S/Zn/q+2

InChIKey

PTFCDOFLOPIGGS-UHFFFAOYSA-N

SMILES

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

Formula

Name

ZINC ION

PDB chain

6sj2 Chain A Residue 502 [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	6sj2 The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Resolution	1.25 Å
Binding residue (original residue number in PDB)	H75 H77 H253 D345
Binding residue (residue number reindexed from 1)	H76 H78 H254 D346
Annotation score	4

Enzymatic activity

Enzyme Commision number

Gene Ontology

	Molecular Function
GO:0016787	hydrolase activity
GO:0016810	hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
GO:0046872	metal ion binding

View graph for
Molecular Function

External links

PDB	RCSB:6sj2, PDBe:6sj2, PDBj:6sj2
PDBsum	6sj2
PubMed	31903677
UniProt	A0A022MQ12

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