Structure of PDB 7f7q Chain A Binding Site BS01

Receptor Information
>7f7q Chain A (length=898) Species: 1169312 (Enterococcus faecalis ATCC 10100) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVGAIVSIEKAEKNFVITYASGKKAQISILNDHLFRYHLDPTGKFEEYPT
PNDPKHVAKITAKTMADYGTQAFEQTNVTDSGNQFILENNGLKIIFEKES
ALMKVLDKKKNQVILEETAPLSFKNDKATQTLKQSSQENYFGGGTQNGRF
THKGTAIQIVNTNNWVDGGVASPNPFYWSTAGYGVVRNTWKPGNYDFGSH
DPQTTTTTHEGTDFDAFYFFNDSSAGILKDYYELTGKPALMPEYGFYEAH
LNAYNRDYWVKVAEGTAGAVKFEDGNFYKEYQPGDLGNLNGTLESLNGEK
ENYQFSARAVIDRYKKNDMPLGWFLPNDGYGAGYGQTDSLDGDVQNLKEF
TDYAQANGVEVGLWTQSNLHPADPKNPKKGERDIAKEVSVAGVKALKTAV
AWVGYGYSFGLNGVEDAANVFVKETDGAVRPMIVSLDGWAGTQRHAGIWT
GDQTGGQWEYIRFHIPTYIGTSLSGQPNVGSDMDGIFGGKNKEVNIRDFQ
WKTFTPVQLNMDGWGSNPKTPFAFDQEATDLNRAYLKLKSMMMPYNYSIA
KESVDGLPMVRAMALEFPNEGTAYTKDSQYQYMWGPNLLVAPIYNGNQDE
AGNSIRDGIYLPDEKQVWVDLFTGEKYQGGRVLNGVKTPLWKVPVFVKDG
SIIPMTNPNNNPKEIQRDQRSFLIYPNGATSFNMYEDDGISTSYEAGQSA
TTKINSQGPKSNEKGDLTVTIEPTKGSYKDFVDERSTTLDLLASEAPESV
TAMVGGTEVTLKQAANKEEFLAGTNLYYFDKEFQVNQYLSEASGEKLNQS
ALSVKLAKQSVTAKDVQITVKGFINKGTVDGGNTTVDAINEEKTTPSSLT
LQWTSYEVERDGTVFGNIQTNTATFDGFSHTFRVRAVGKNGVSEWSEP
Ligand information
Ligand IDNPO
InChIInChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
InChIKeyBTJIUGUIPKRLHP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Oc1ccc(cc1)[N+]([O-])=O
ACDLabs 10.04O=[N+]([O-])c1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1[N+](=O)[O-])O
FormulaC6 H5 N O3
NameP-NITROPHENOL
ChEMBLCHEMBL14130
DrugBankDB04417
ZINCZINC000034828682
PDB chain7f7q Chain A Residue 1002 [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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PDB7f7q Structural and mechanistic insights into the substrate specificity and hydrolysis of GH31 alpha-N-acetylgalactosaminidase.
Resolution1.42 Å
Binding residue
(original residue number in PDB)		Y386 D508 F543 W570
Binding residue
(residue number reindexed from 1)		Y330 D452 F487 W514
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0030246 carbohydrate binding
Biological Process
GO:0005975 carbohydrate metabolic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:7f7q, PDBe:7f7q, PDBj:7f7q
PDBsum7f7q
PubMed34826537
UniProtQ833V2

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