Structure of PDB 8uml Chain A Binding Site BS02

Receptor Information
>8uml Chain A (length=443) Species: 4577 (Zea mays) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GAEEIVLQPIKEISGTVKLPGSKSLSNRILLLAALSEGTTVVDNLLNSED
VHYMLGALRTLGLSVEADKAAKRAVVVGCGGKFPVEDSKEEVQLFLGNAG
IAMRSLTAAVTAAGGNATYVLDGVSRMRERPIGDLVVGLKQLGADVDCFL
GTDCPPVRVNGIGGLPGGKVKLSGSISSQYLSALLMAAPLALGDVEIEII
DKLISIPYVEMTLRLMERFGVKAEHSDSWDRFYIKGGQKYKSPKNAYVEG
DASSASYFLAGAAITGGTVTVEGCGTTSLQGDVKFAEVLEMMGAKVTWTE
TSVTVTGPPREPFGRKHLKAIDVNMNKMPDVAMTLAVVALFADGPTAIRD
VASWRVKETERMVAIRTELTKLGASVEEGPDYCIITPPEKLNVTAIDTYD
DHRMAMAFSLAACAEVPVAIRDPGCTRKTFPDYFDVLSTFVKN
Ligand information
Ligand IDGPJ
InChIInChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)/p+1
InChIKeyXDDAORKBJWWYJS-UHFFFAOYSA-O
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(=O)O)[NH2+]CP(=O)(O)O
CACTVS 3.341OC(=O)C[NH2+]C[P](O)(O)=O
ACDLabs 10.04O=C(O)C[NH2+]CP(=O)(O)O
FormulaC3 H9 N O5 P
NameGLYPHOSATE
ChEMBL
DrugBankDB04539
ZINC
PDB chain8uml Chain A Residue 502 [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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PDB8uml Evolving dual-trait EPSP synthase variants using a synthetic yeast selection system.
Resolution1.83 Å
Binding residue
(original residue number in PDB)
K24 G101 R131 Q180 D331 E359 R362 H403 R404
Binding residue
(residue number reindexed from 1)
K23 G100 R130 Q179 D330 E358 R361 H402 R403
Annotation score1
External links