Structure of PDB 7exr Chain B Binding Site BS01

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 3 [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)		K75 W78 W314 M426 D446 D447 Y449
Binding residue
(residue number reindexed from 1)		K71 W74 W283 M395 D415 D416 Y418
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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