Structure of PDB 7exr Chain B Binding Site BS02

Receptor Information
>7exr Chain B (length=718) Species: 3702 (Arabidopsis thaliana) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PAVRISDGNLIIKNRTILTGVPDNVITTSASEAGPVEGVFVGAVFNKEES
KHIVPIGTLRNSRFMSCFRFKLWWMAQRMGEMGRDIPYETQFLLVESNKV
YTVFLPLIEGSFRSCLQGNVNDEVELCLESGDVDTKRSSFTHSLYIHAGT
DPFQTITDAIRTVKLHLNSFRQRHEKKLPGIVDYFGWCTWDAFYQEVTQE
GVEAGLKSLAAGGTPPKFVIIDDGWQSVERDASPIFRLTGIKENEKFKKK
DDPNVGIKNIVKIAKEKHGLRYVYVWHAITGYWGGVRPGEEYGSVMKYPN
MSKGVVENDPTWKTDVMTLQGLGLVSPKKVYKFYNELHSYLADAGVDGVK
VAVQCVLETLGGGLGGRVELTRQFHQALDSSVAKNFPDNGCIACMSHNTD
ALYCSKQAAVIRASDDFYPRDPVSHTIHIASVAYNSVFLGEFMQPDWDMF
HSVHPAAEYHASARAISGGPLYVSDSPGKHNFELLRKLVLPDGSILRARL
PGRPTRDCLFADPARDGVSLLKIWNMNKYTGVLGVYNCQGAAWSSTERKN
IFHQTKTDSLTGSIRGRDVHSISEASTDPTTWNGDCAVYSQSRGELIVMP
YNVSLPVSLKIREHEIFTVSPISHLVDGVSFAPIGLVNMYNSGGAIEGLR
YEAEKMKVVMEVKGCGKFGSYSSVKPKRCVVESNEIAFEYDSSSGLVTFE
LDKMPIENKRFHLIQVEL
Ligand information
Ligand IDGLA
InChIInChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6+/m1/s1
InChIKeyWQZGKKKJIJFFOK-PHYPRBDBSA-N
SMILES
SoftwareSMILES
CACTVS 3.341OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-galactopyranose;
alpha-D-galactose;
D-galactose;
galactose;
ALPHA D-GALACTOSE
ChEMBLCHEMBL1233058
DrugBank
ZINCZINC000000901155
PDB chain7exr Chain D Residue 4 [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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PDB7exr Structural insight into the hydrolase and synthase activities of an alkaline alpha-galactosidase from Arabidopsis from complexes with substrate/product.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		W211 D243 D244 W307 K381 C425 R443 D447
Binding residue
(residue number reindexed from 1)		W190 D222 D223 W276 K350 C394 R412 D416
Annotation score2
Enzymatic activity
Enzyme Commision number 2.4.1.82: galactinol--sucrose galactosyltransferase.
Gene Ontology
Molecular Function
GO:0016757 glycosyltransferase activity
GO:0047274 galactinol-sucrose galactosyltransferase activity

View graph for
Molecular Function
External links
PDB RCSB:7exr, PDBe:7exr, PDBj:7exr
PDBsum7exr
PubMed36762861
UniProtQ8RX87|RFS6_ARATH Probable galactinol--sucrose galactosyltransferase 6 (Gene Name=RFS6)

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