Structure of PDB 1mr8 Chain B Binding Site BS02
Receptor Information
>1mr8 Chain B (length=90) Species:
9606
(Homo sapiens) [
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MLTELEKALNSIIDVYHKYSLIKGNFHAVYRDDLKKLLETECPQYIRKKG
ADVWFKELDINTDGAVNFQEFLILVIKMGVAAHKKSHEES
Ligand information
Ligand ID
CA
InChI
InChI=1S/Ca/q+2
InChIKey
BHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
Formula
Ca
Name
CALCIUM ION
ChEMBL
DrugBank
DB14577
ZINC
PDB chain
1mr8 Chain B Residue 102 [
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Receptor-Ligand Complex Structure
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PDB
1mr8
The structure of human MRP8, a member of the S100 calcium-binding protein family, by MAD phasing at 1.9 A resolution.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
S20 K23 N25 A28
Binding residue
(residue number reindexed from 1)
S20 K23 N25 A28
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005509
calcium ion binding
GO:0005515
protein binding
GO:0008017
microtubule binding
GO:0008270
zinc ion binding
GO:0035662
Toll-like receptor 4 binding
GO:0046872
metal ion binding
GO:0048306
calcium-dependent protein binding
GO:0050544
arachidonate binding
GO:0050786
RAGE receptor binding
Biological Process
GO:0002523
leukocyte migration involved in inflammatory response
GO:0002544
chronic inflammatory response
GO:0002790
peptide secretion
GO:0002793
positive regulation of peptide secretion
GO:0006914
autophagy
GO:0006915
apoptotic process
GO:0006919
activation of cysteine-type endopeptidase activity involved in apoptotic process
GO:0006935
chemotaxis
GO:0006954
inflammatory response
GO:0010043
response to zinc ion
GO:0014002
astrocyte development
GO:0018119
peptidyl-cysteine S-nitrosylation
GO:0030307
positive regulation of cell growth
GO:0030593
neutrophil chemotaxis
GO:0032119
sequestering of zinc ion
GO:0032496
response to lipopolysaccharide
GO:0034121
regulation of toll-like receptor signaling pathway
GO:0035425
autocrine signaling
GO:0042742
defense response to bacterium
GO:0045087
innate immune response
GO:0045471
response to ethanol
GO:0050729
positive regulation of inflammatory response
GO:0050832
defense response to fungus
GO:0051092
positive regulation of NF-kappaB transcription factor activity
GO:0051493
regulation of cytoskeleton organization
GO:0070488
neutrophil aggregation
GO:2001244
positive regulation of intrinsic apoptotic signaling pathway
Cellular Component
GO:0005576
extracellular region
GO:0005615
extracellular space
GO:0005634
nucleus
GO:0005737
cytoplasm
GO:0005829
cytosol
GO:0005856
cytoskeleton
GO:0005886
plasma membrane
GO:0034774
secretory granule lumen
GO:0045111
intermediate filament cytoskeleton
GO:0062023
collagen-containing extracellular matrix
GO:0070062
extracellular exosome
GO:1990660
calprotectin complex
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1mr8
,
PDBe:1mr8
,
PDBj:1mr8
PDBsum
1mr8
PubMed
10771424
UniProt
P05109
|S10A8_HUMAN Protein S100-A8 (Gene Name=S100A8)
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