Structure of PDB 8wsm Chain A

Receptor sequence
>8wsmA (length=472) Species: 9606 (Homo sapiens) [Search protein sequence]
KDYRKKYRKYVRSRFQCIEVSLNKRYTRLRLIKESPIKMELLFDPDSEPV
HTVVFQGAAGIGKTILARKMMLDWASGTLYQDRFDYLFYIHCREVSLVTQ
RSLGDLIMSCCPDPNPPIHKIVRKPSRILFLMDGFDELQGAFDEHIGPLC
TDWQKAERGDILLSSLIRKKLLPEASLLITTRPVALEKLQHLLDHPRHVE
ILGFSEAKRKEYFFKYFSDEAQARAAFSLIQENEVLFTMCFIPLVCWIVC
TGLKQQMESGKSLAQTSKTTTAVYVFFLSSLLCAHLWGLCSLAADGIWNQ
KILFEESDLRNHGLQKADVSAFLRMNLFQKEKFYSFIHMTFQEFFAAMYY
LLEEPSRDVTVLLENYGKFEKGYLIFVVRFLFGLVNQERTSYLEKKLSCK
ISQQIRLELLKWIEVKAKIQPSQLELFYCLYEMQEEDFVQRAMDYFPKIE
INLSTRMDHMVSSFCIENCHRV
3D structure
PDB8wsm Discovery of Novel NLRP3 Inflammasome Inhibitors Composed of an Oxazole Scaffold Bearing an Acylsulfamide.
ChainA
Resolution2.7 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 3.6.4.-
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 ADP A Y168 T169 G229 G231 K232 T233 I234 Y381 P412 H522 Y26 T27 G60 G62 K63 T64 I65 Y212 P243 H338
BS02 XE3 A A227 A228 R351 P352 V353 M408 T439 F575 R578 M661 A58 A59 R182 P183 V184 M239 T270 F376 R379 M457
External links
PDB RCSB:8wsm, PDBe:8wsm, PDBj:8wsm
PDBsum8wsm
PubMed38116417
UniProtQ96P20|NLRP3_HUMAN NACHT, LRR and PYD domains-containing protein 3 (Gene Name=NLRP3)

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