Structure of PDB 5nw7 Chain A Binding Site BS01

Receptor Information
>5nw7 Chain A (length=440) Species: 5476 (Candida albicans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SSEKLFRIQCGYQNYDWGKIGSSSAVAQFVHNSDPSITIDETKPYAELWM
GTHPSVPSKAIDLNNQTLRDLVTAKPQEYLGESIITKFGSSKELPFLFKV
LSIEKVLSIQAHPDKKLGAQLHAADPKNYPDDNHKPEMAIAVTDFEGFCG
FKPLDQLAKTLATVPELNEIIGQELVDEFISGIKLPAEVGSQDDVNNRKL
LQKVFGKLMNTDDDVIKQQTAKLLERTDREPQVFKDIDSRLPELIQRLNK
QFPNDIGLFCGCLLLNHVGLNKGEAMFLQAKDPHAYISGDIIECMAASDN
VVRAGFTPKFKDVKNLVEMLTYSYESVEKQKMPLQEFPRSKGDAVKSVLY
DPPIAEFSVLQTIFDKSKGGKQVIEGLNGPSIVIATNGKGTIQITGDDST
KQKIDTGYVFFVAPGSSIELTADSANQDQDFTTYRAFVEA
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5nw7 Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5nw7 Crystal structure of phosphomannose isomerase from Candida albicans complexed with 5-phospho-d-arabinonhydrazide.
Resolution1.85 Å
Binding residue
(original residue number in PDB)		Q111 H113 E138 H285
Binding residue
(residue number reindexed from 1)		Q110 H112 E137 H284
Annotation score1
Enzymatic activity
Enzyme Commision number 5.3.1.8: mannose-6-phosphate isomerase.
Gene Ontology
Molecular Function
GO:0004476 mannose-6-phosphate isomerase activity
GO:0008270 zinc ion binding
GO:0016853 isomerase activity
GO:0046872 metal ion binding
Biological Process
GO:0000032 cell wall mannoprotein biosynthetic process
GO:0005975 carbohydrate metabolic process
GO:0006486 protein glycosylation
GO:0009298 GDP-mannose biosynthetic process
GO:0031505 fungal-type cell wall organization
Cellular Component
GO:0005575 cellular_component
GO:0005737 cytoplasm
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5nw7, PDBe:5nw7, PDBj:5nw7
PDBsum5nw7
PubMed29687459
UniProtP34948|MPI_CANAL Mannose-6-phosphate isomerase (Gene Name=PMI1)

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