2025-10-25_00000121
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ligand
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9K76
Crystal structure of human STING in complex with F2W;
X-ray diffraction 2.17Å
Protein #1
191 residues (89% resolved)
Raw Sequence ...
FNVAHGLAWSYYIGYLRLILPELQARIRTYNQHYNNLLRGAVSQRLYILLPLDCGVPDNLSMADPNIRFLDKLPQQTGDHAGIKDRVYSNSIYELLENGQRAGTCVLEYATPLQTLFAMSQYSQAGFSREDRLEQAKLFCRTLEDILADAPESQNNCRLIAYQEPADDSSFSLSQEVLHHLRQEEKEEVTV
Canonical Sequence ...
FNVAHGLAWSYYIGYLRLILPELQARIRTYNQHYNNLLRGAVSQRLYILLPLDCGVPDNLSMADPNIRFLDKLPQQTGDHAGIKDRVYSNSIYELLENGQRAGTCVLEYATPLQTLFAMSQYSQAGFSREDRLEQAKLFCRTLEDILADAPESQNNCRLIAYQEPADDSSFSLSQEVLHHLRQEEKEEVTV
Non polymer #2
1T2
InChI=1S/C17H12ClNO6S/c1-26(23,24)11-5-2-9(3-6-11)16(20)19-14-12-8-10(18)4-7-13(12)25-15(14)17(21)22/h2-8H,1H3,(H,19,20)(H,21,22)
InChI=1S/C17H12ClNO6S/c1-26(23,24)11-5-2-9(3-6-11)16(20)19-14-12-8-10(18)4-7-13(12)25-15(14)17(21)22/h2-8H,1H3,(H,19,20)(H,21,22)
SMILES: CS(=O)(=O)c1ccc(cc1)C(=O)Nc2c3cc(ccc3oc2C(=O)O)Cl
CS(=O)(=O)c1ccc(cc1)C(=O)Nc2c3cc(ccc3oc2C(=O)O)Cl
Biounit #1
homo-dimer
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Model
Reference
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