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Structure of PDB 4fro Chain A Binding Site BS02

Receptor Information >4fro Chain A (length=276) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] MVYPQPKVLTPCRKDVLVVTPWLAPIVWEGTFNIDILNEQFRLQNTTIGL TVFAIKKYVAFLKLFLETAEKHFMVGHRVHYYVFTDQPAAVPRVTLGTGR QLSVLEVGAYKRWQDVSMRRMEMISCERRFLSEVDYLVCVDVDMEFRDHV GVEILTPLFGTLHPSFYGSSREAFTYERRPQSQAYIPKDEGDFYYMGAFF GGSVQEVQRLTRACHQAMMVDQANGIEAVWHDESHLNKYLLRHKPTKVLS PEYLWDQQLLGWPAVLRKLRFTAVPK

Ligand information Ligand ID GLY InChI InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) InChIKey DHMQDGOQFOQNFH-UHFFFAOYSA-N SMILES Software SMILES OpenEye OEToolkits 1.5.0 C(C(=O)O)N CACTVS 3.341 NCC(O)=O ACDLabs 10.04 O=C(O)CN Formula C2 H5 N O2 Name GLYCINE ChEMBL CHEMBL773 DrugBank DB00145 ZINC ZINC000004658552 PDB chain 4fro Chain A Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 4fro pH-induced conformational changes in human ABO(H) blood group glycosyltransferases confirm the importance of electrostatic interactions in the formation of the semi-closed state. Resolution 1.75 Å Binding residue (original residue number in PDB) H140 H219 Binding residue (residue number reindexed from 1) H72 H149 Annotation score 1

Enzymatic activity Catalytic site (original residue number in PDB) H233 M266 W300 E303 A343 Catalytic site (residue number reindexed from 1) H163 M196 W230 E233 A273 Enzyme Commision number 2.4.1.37: fucosylgalactoside 3-alpha-galactosyltransferase. 2.4.1.40: glycoprotein-fucosylgalactoside alpha-N-acetylgalactosaminyltransferase.

Gene Ontology Molecular Function GO:0016758 hexosyltransferase activity

	Biological Process
GO:0005975	carbohydrate metabolic process

	Cellular Component
GO:0016020	membrane

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