Structure of PDB 8ui1 Chain A Binding Site BS02

Receptor Information
>8ui1 Chain A (length=521) Species: 508771 (Toxoplasma gondii ME49) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYL
SDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVH
SVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRN
EVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRV
VMPQIDGIDAETFKHIAGGCKLGFLWKLMEHSYEGHQTARLPPEERQPSP
TDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLELSFRLWQCGG
VLECAPCSRVYHIFRKGGPGDSITINKMRTMLWMDEYADLAWRVIGKPRV
NYRPESLEKRREWRKRKGCKSFRWFMENVFPEGDVVTLDDVPYLGPLRND
KIGMCLDNMGWASPGHAVGLEYCHGGDTQTFMFFRKVGHVMPVNDDEACL
QPSGRLDWCRGTAQFWWDFTSSGQLMFRETKQCLSAFGRKLRMVECDDTD
PYQIWSWTAYNPPDTFTFPSV
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain8ui1 Chain A Residue 702 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8ui1 A Toxoplasma gondii O-glycosyltransferase that modulates bradyzoite cyst wall rigidity is distinct from host homologues.
Resolution2.91 Å
Binding residue
(original residue number in PDB)		D276 H278 H414
Binding residue
(residue number reindexed from 1)		D176 H178 H312
Annotation score1
Enzymatic activity
Enzyme Commision number 2.4.1.41: polypeptide N-acetylgalactosaminyltransferase.
External links