8XYK: CXCR3
Structure of CXCR3 in complex with VUF10661 and Go (Full map). Determined by electron microscopy at 3.03 Å resolution. Released 26 Feb 2025.
- Method
- Electron microscopy
- Resolution
- 3.03 Å
- Organisms
- Homo sapiens, Mus musculus
- Chains
- 5
- Atoms
- 8,807
- Mol. weight
- 147.13 kDa
- Ligands
- A1LW1
- Released
- 26 Feb 2025
Explore 8XYK in 3D
Show helices and sheets
RCSB PDB
PDBe
Secondary structure: helices and β-sheets
8XYK contains 35 α-helices and 63 β-strands across 5 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.
Chain A: 7 helices, 8 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 7-29 | 23 | |
| β-strand | 33-39 | 7 | 2 |
| β-strand | 186-188 | 3 | 2 |
| β-strand | 191 | 1 | 2 |
| β-strand | 196-201 | 6 | 2 |
| α-helix | 209-211 | 3 | |
| α-helix | 213-216 | 4 | |
| β-strand | 221-227 | 7 | 2 |
| α-helix | 244-255 | 12 | |
| β-strand | 264-270 | 7 | 2 |
| α-helix | 272-281 | 10 | |
| α-helix | 297-309 | 13 | |
| β-strand | 319 | 1 | 2 |
| β-strand | 322-323 | 2 | 2 |
| α-helix | 331-350 | 20 | |
Chain B: 3 helices, 28 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 6-25 | 20 | |
| α-helix | 30-33 | 4 | |
| β-strand | 47-52 | 6 | 3 |
| β-strand | 58-63 | 6 | 4 |
| β-strand | 69-74 | 6 | 4 |
| β-strand | 78-83 | 6 | 4 |
| β-strand | 88-94 | 7 | 4 |
| β-strand | 100-105 | 6 | 5 |
| β-strand | 111-116 | 6 | 5 |
| β-strand | 121-125 | 5 | 5 |
| β-strand | 134-139 | 6 | 5 |
| β-strand | 146-153 | 8 | 6 |
| β-strand | 156-161 | 6 | 6 |
| β-strand | 165-169 | 5 | 6 |
| β-strand | 176-181 | 6 | 6 |
| β-strand | 187-192 | 6 | 7 |
| β-strand | 198-203 | 6 | 7 |
| β-strand | 207-212 | 6 | 7 |
| β-strand | 217-223 | 7 | 7 |
| β-strand | 229-234 | 6 | 8 |
| β-strand | 240-245 | 6 | 8 |
| β-strand | 250-254 | 5 | 8 |
| β-strand | 259-263 | 5 | 8 |
| α-helix | 272 | 1 | |
| β-strand | 273-278 | 6 | 9 |
| β-strand | 284-289 | 6 | 9 |
| β-strand | 293-298 | 6 | 9 |
| β-strand | 304-309 | 6 | 9 |
| β-strand | 315-320 | 6 | 3 |
| β-strand | 327-331 | 5 | 3 |
| β-strand | 335-339 | 5 | 3 |
Chain G: 4 helices, 0 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 11-23 | 13 | |
| α-helix | 30-43 | 14 | |
| α-helix | 53-55 | 3 | |
| α-helix | 56-58 | 3 | |
Chain R: 14 helices, 2 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 47-67 | 21 | |
| α-helix | 68-72 | 5 | |
| α-helix | 73-79 | 7 | |
| α-helix | 87-104 | 18 | |
| α-helix | 106-114 | 9 | |
| α-helix | 120-153 | 34 | |
| α-helix | 169-189 | 21 | |
| β-strand | 191-194 | 4 | 1 |
| β-strand | 201-204 | 4 | 1 |
| α-helix | 209-219 | 11 | |
| α-helix | 220-225 | 6 | |
| α-helix | 226-243 | 18 | |
| α-helix | 250-282 | 33 | |
| α-helix | 290-314 | 25 | |
| α-helix | 315-319 | 5 | |
| α-helix | 323-334 | 12 | |
Chain S: 7 helices, 25 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 3-7 | 5 | 10 |
| β-strand | 10-12 | 3 | 11 |
| β-strand | 18-25 | 8 | 10 |
| α-helix | 29-31 | 3 | |
| β-strand | 33-40 | 8 | 11 |
| β-strand | 44-51 | 8 | 11 |
| β-strand | 58-60 | 3 | 11 |
| β-strand | 65 | 1 | 10 |
| β-strand | 68-73 | 6 | 10 |
| β-strand | 78-83 | 6 | 10 |
| α-helix | 88-90 | 3 | |
| β-strand | 92-99 | 8 | 11 |
| β-strand | 111 | 1 | 11 |
| β-strand | 115-119 | 5 | 11 |
| α-helix | 125-127 | 3 | |
| β-strand | 128-129 | 2 | 12 |
| β-strand | 134-136 | 3 | 13 |
| β-strand | 143-149 | 7 | 12 |
| β-strand | 154 | 1 | 14 |
| β-strand | 160 | 1 | 14 |
| β-strand | 162-167 | 6 | 13 |
| β-strand | 174-177 | 4 | 13 |
| α-helix | 182 | 1 | |
| β-strand | 183 | 1 | 13 |
| α-helix | 184 | 1 | |
| β-strand | 191-196 | 6 | 12 |
| β-strand | 199-204 | 6 | 12 |
| α-helix | 209-211 | 3 | |
| β-strand | 214-219 | 6 | 13 |
| α-helix | 225 | 1 | |
| β-strand | 226 | 1 | 13 |
| β-strand | 231-234 | 4 | 13 |
Molecules and chains
| Molecule | Chains | Type | Length | Organism | UniProt |
|---|
| C-X-C chemokine receptor type 3 | R | protein | 424 | Homo sapiens | P49682 (AlphaFold model) |
| Guanine nucleotide-binding protein G(o) subunit alpha | A | protein | 240 | Homo sapiens | P09471 (AlphaFold model) |
| Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1 | B | protein | 350 | Homo sapiens | P62873 (AlphaFold model) |
| Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2 | G | protein | 71 | Homo sapiens | P59768 (AlphaFold model) |
| Antibody fragment ScFv16 | S | protein | 248 | Mus musculus | |
Sequence of entity 1 (R), FASTA
>8XYK_1 C-X-C chemokine receptor type 3 (chains R)
MGKTIIALSYIFCLVFADYKDDDDAANFTPVNGSSGNQSVRLVTSSSLEVLFQGPGSVLE
VSDHQVLNDAEVAALLENFSSSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLF
LLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVLTLPLWAVDAAVQWVFGSGLC
KVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCLLFAL
PDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLV
SRGQRRLRAMRLVVVVVVAFALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTS
GLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGLQRQPSSSRRDSSWSETSEAS
YSGL
Sequence of entity 2 (A), FASTA
>8XYK_2 Guanine nucleotide-binding protein G(o) subunit alpha (chains A)
MGHHHHHHENLYFQGTLSAEERAALERSKAIEKNLKEDGISAAKDVKLLLLGADNSGKST
IVKQMKIIHGGSGGSGGTTGIVETHFTFKNLHFRLFDVGGQRSERKKWIHCFEDVTAIIF
CVDLSDYNRMHESLMLFDSICNNKFFIDTSIILFLNKKDLFGEKIKKSPLTICFPEYTGP
NTYEDAAAYIQAQFESKNRSPNKEIYCHMTCATDTNNAQVIFDAVTDIIIANNLRGCGLY
Sequence of entity 3 (B), FASTA
>8XYK_3 Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1 (chains B)
MHHHHHHGSSGSELDQLRQEAEQLKNQIRDARKACADATLSQITNNIDPVGRIQMRTRRT
LRGHLAKIYAMHWGTDSRLLVSASQDGKLIIWDSYTTNKVHAIPLRSSWVMTCAYAPSGN
YVACGGLDNICSIYNLKTREGNVRVSRELAGHTGYLSCCRFLDDNQIVTSSGDTTCALWD
IETGQQTTTFTGHTGDVMSLSLAPDTRLFVSGACDASAKLWDVREGMCRQTFTGHESDIN
AICFFPNGNAFATGSDDATCRLFDLRADQELMTYSHDNIICGITSVSFSKSGRLLLAGYD
DFNCNVWDALKADRAGVLAGHDNRVSCLGVTDDGMAVATGSWDSFLKIWN
Sequence of entity 4 (G), FASTA
>8XYK_4 Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2 (chains G)
MASNNTASIAQARKLVEQLKMEANIDRIKVSKAAADLMAYCEAHAKEDPLLTPVPASENP
FREKKFFCAIL
Sequence of entity 5 (S), FASTA
>8XYK_5 Antibody fragment ScFv16 (chains S)
DVQLVESGGGLVQPGGSRKLSCSASGFAFSSFGMHWVRQAPEKGLEWVAYISSGSGTIYY
ADTVKGRFTISRDDPKNTLFLQMTSLRSEDTAMYYCVRSIYYYGSSPFDFWGQGTTLTVS
SGGGGSGGGGSGGGGSDIVMTQATSSVPVTPGESVSISCRSSKSLLHSNGNTYLYWFLQR
PGQSPQLLIYRMSNLASGVPDRFSGSGSGTAFTLTISRLEAEDVGVYYCMQHLEYPLTFG
AGTKLELK
Ligands and cofactors
| ID | Name | Formula | Copies |
|---|
| A1LW1 | (3~{S})-~{N}-[(2~{S})-6-azanyl-1-(2,2-diphenylethylamino)-1-oxidanylidene-hexan… | C40 H44 N4 O4 | 1 |
Primary citation
Structural visualization of small molecule recognition by CXCR3 uncovers dual-agonism in the CXCR3-CXCR7 system. Saha, S., Sano, F.K., Sharma, S. et al. Nat Commun (2025) 16:3047-3047. DOI 10.1038/s41467-025-58264-w · PubMed
Other PDB entries of the same protein (UniProt P49682 (AlphaFold model), which also has an AlphaFold model), best resolution first:
- 8HNM 2.94 Å, CXCR3-DNGi complex activated by VUF11222
- 9P0M 2.95 Å, Composite map of CXCL11-CXCR3-Gi-scFv16
- 8HNL 2.98 Å, CXCR3-DNGi complex activated by PS372424
- 8K2W 3.0 Å, Structure of CXCR3 complexed with antagonist AMG487
- 8HNK 3.01 Å, CXCR3-DNGi complex activated by CXCL11
- 8Y0N 3.07 Å, Structure of CXCR3 in complex with VUF11418 and Go (Full map)
- 9P0L 3.1 Å, Composite map of CXCL10-CXCR3-Gi-scFv16
- 8XYI 3.16 Å, Structure of CXCR3 in complex with VUF10661 (Receptor-ligand focused map)
- 8K2X 3.2 Å, CXCR3-DNGi complex activated by CXCL10
- 8XXZ 3.3 Å, Structure of CXCR3 in the apo-state (Full map)
- 9P0K 3.5 Å, Composite map of CXCL9-CXCR3-Gi-scFv16
- 8Y0H 3.53 Å, Structure of CXCR3 in complex with VUF11418 (Receptor-ligand focused map)
Browse structure collections
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