Structure of PDB 3uk4 Chain A Binding Site BS04

Receptor Information
>3uk4 Chain A (length=335) Species: 9913 (Bos taurus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YTRVVWCAVGPEEQKKCQQWSQQSGQNVTCATASTTDDCIVLVLKGEADA
LNLDGGYIYTAGKCGLVPVLAENRKSSKHSSLDCVLRPTEGYLAVAVVKK
ANEGLTWNSLKDKKSCHTAVDRTAGWNIPMGLIVNQTGSCAFDEFFSQSC
APGADPKSRLCALCAGDDQGLDKCVPNSKEKYYGYTGAFRCLAEDVGDVA
FVKNDTVWENTNGESTADWAKNLKREDFRLLCLDGTRKPVTEAQSCHLAV
APNHAVVSRSDRAAHVEQVLLHQQALFGKNGKNCPDKFCLFKSETKNLLF
NDNTECLAKLGGRPTYEEYLGTEYVTAIANLKKCS
Ligand information
Ligand IDXXD
InChIInChI=1S/C5H12O3/c6-3-1-2-5(8)4-7/h5-8H,1-4H2/t5-/m0/s1
InChIKeyWEAYWASEBDOLRG-YFKPBYRVSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.2C(C[C@@H](CO)O)CO
OpenEye OEToolkits 1.7.2C(CC(CO)O)CO
CACTVS 3.370OCCC[CH](O)CO
CACTVS 3.370OCCC[C@H](O)CO
ACDLabs 12.01OCCCC(O)CO
FormulaC5 H12 O3
Name(2S)-pentane-1,2,5-triol
ChEMBL
DrugBank
ZINCZINC000002045369
PDB chain3uk4 Chain A Residue 677 [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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PDB3uk4 Crystal Structure of C-lobe of Bovine lactoferrin Complexed with 1,2,5-Pentanetriol at 1.98 A Resolution
Resolution1.98 Å
Binding residue
(original residue number in PDB)		G662 T663 E664
Binding residue
(residue number reindexed from 1)		G321 T322 E323
Annotation score1
Enzymatic activity
Enzyme Commision number 3.4.21.-
Gene Ontology
Cellular Component
GO:0005576 extracellular region

View graph for
Cellular Component
External links
PDB RCSB:3uk4, PDBe:3uk4, PDBj:3uk4
PDBsum3uk4
PubMed
UniProtP24627|TRFL_BOVIN Lactotransferrin (Gene Name=LTF)

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