3PQY: 6218 TCR
Crystal Structure of 6218 TCR in complex with the H2Db-PA224. Determined by X-ray diffraction at 3.19 Å resolution. Released 18 May 2011.
- Method
- X-ray diffraction
- Resolution
- 3.19 Å
- Organisms
- Mus musculus, synthetic construct, Homo sapiens
- Chains
- 20
- Atoms
- 25,956
- Mol. weight
- 376.43 kDa
- Released
- 18 May 2011
Explore 3PQY in 3D
Show helices and sheets
RCSB PDB
PDBe
Secondary structure: helices and β-sheets
3PQY contains 70 α-helices and 297 β-strands across 16 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, 19 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 3-12 | 10 | 1 |
| β-strand | 21-28 | 8 | 1 |
| β-strand | 32-37 | 6 | 1 |
| β-strand | 46-47 | 2 | 1 |
| α-helix | 57-85 | 29 | |
| α-helix | 87-88 | 2 | |
| β-strand | 94-103 | 10 | 1 |
| β-strand | 109-118 | 10 | 1 |
| β-strand | 121-126 | 6 | 1 |
| β-strand | 133-135 | 3 | 1 |
| α-helix | 140-149 | 10 | |
| α-helix | 152-157 | 6 | |
| α-helix | 158-164 | 7 | |
| α-helix | 165-175 | 11 | |
| β-strand | 183 | 1 | 2 |
| β-strand | 188-193 | 6 | 3 |
| β-strand | 198-208 | 11 | 3 |
| β-strand | 209 | 1 | 2 |
| β-strand | 213-219 | 7 | 4 |
| β-strand | 222-224 | 3 | 4 |
| β-strand | 229-230 | 2 | 3 |
| β-strand | 234-235 | 2 | 3 |
| β-strand | 241-250 | 10 | 3 |
| α-helix | 254-256 | 3 | |
| β-strand | 257-263 | 7 | 4 |
| β-strand | 270-272 | 3 | 4 |
Chain B: 1 helix, 11 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 3 | 1 | 5 |
| β-strand | 6-11 | 6 | 6 |
| β-strand | 21-30 | 10 | 6 |
| β-strand | 31 | 1 | 5 |
| β-strand | 35-41 | 7 | 7 |
| β-strand | 44-45 | 2 | 7 |
| β-strand | 50-51 | 2 | 6 |
| α-helix | 52-54 | 3 | |
| β-strand | 55-56 | 2 | 6 |
| β-strand | 62-70 | 9 | 6 |
| β-strand | 78-84 | 7 | 7 |
| β-strand | 91-94 | 4 | 7 |
Chain D: 4 helices, 16 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 5 | 1 | 8 |
| β-strand | 10-14 | 5 | 9 |
| α-helix | 17 | 1 | |
| β-strand | 18-25 | 8 | 8 |
| β-strand | 32-44 | 8 | 9 |
| β-strand | 51-56 | 6 | 9 |
| β-strand | 68 | 1 | 8 |
| β-strand | 80-83 | 4 | 8 |
| α-helix | 84 | 1 | |
| β-strand | 85-93 | 9 | 8 |
| α-helix | 96-98 | 3 | |
| β-strand | 100-108 | 9 | 9 |
| β-strand | 120-125 | 6 | 9 |
| β-strand | 135-138 | 4 | 10 |
| β-strand | 139 | 1 | 11 |
| β-strand | 146-151 | 6 | 10 |
| β-strand | 168-169 | 2 | 10 |
| α-helix | 170-172 | 3 | |
| β-strand | 173-174 | 2 | 10 |
| β-strand | 185-190 | 6 | 10 |
Chain E: 8 helices, 26 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 5 | 1 | 12 |
| β-strand | 10-14 | 5 | 13 |
| β-strand | 19-21 | 3 | 14 |
| β-strand | 24 | 1 | 12 |
| β-strand | 31-44 | 7 | 13 |
| β-strand | 50-58 | 9 | 13 |
| β-strand | 61-67 | 3 | 13 |
| β-strand | 77-79 | 3 | 14 |
| β-strand | 86 | 1 | 12 |
| β-strand | 88-91 | 4 | 14 |
| α-helix | 96-98 | 3 | |
| β-strand | 101-107 | 7 | 13 |
| β-strand | 113-114 | 2 | 13 |
| β-strand | 118-123 | 6 | 13 |
| α-helix | 126-128 | 3 | |
| β-strand | 130 | 1 | 15 |
| α-helix | 131-132 | 2 | |
| β-strand | 133-137 | 5 | 11 |
| α-helix | 138-140 | 3 | |
| α-helix | 143-146 | 4 | |
| β-strand | 149-159 | 11 | 11 |
| β-strand | 160 | 1 | 15 |
| β-strand | 164-170 | 7 | 16 |
| β-strand | 173-174 | 2 | 16 |
| β-strand | 179-181 | 3 | 11 |
| α-helix | 185 | 1 | |
| β-strand | 186-187 | 2 | 11 |
| α-helix | 195-196 | 2 | |
| β-strand | 197-206 | 10 | 11 |
| α-helix | 207-210 | 4 | |
| β-strand | 216-223 | 8 | 16 |
| β-strand | 226 | 1 | 17 |
| β-strand | 240 | 1 | 17 |
| β-strand | 242-249 | 8 | 16 |
Chain F: 9 helices, 20 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 3-13 | 11 | 18 |
| α-helix | 20 | 1 | |
| β-strand | 21-28 | 8 | 18 |
| β-strand | 32-37 | 6 | 18 |
| β-strand | 46-47 | 2 | 18 |
| α-helix | 50-52 | 3 | |
| α-helix | 59-84 | 26 | |
| β-strand | 93-98 | 6 | 18 |
| β-strand | 101-103 | 3 | 18 |
| β-strand | 109-112 | 4 | 18 |
| β-strand | 115-119 | 5 | 18 |
| β-strand | 121-126 | 6 | 18 |
| β-strand | 133-135 | 3 | 18 |
| α-helix | 138-150 | 13 | |
| α-helix | 152-158 | 7 | |
| α-helix | 159-164 | 6 | |
| α-helix | 165-173 | 9 | |
| α-helix | 175-177 | 3 | |
| β-strand | 188-195 | 8 | 19 |
| β-strand | 198-204 | 7 | 19 |
| β-strand | 208 | 1 | 20 |
| β-strand | 214-217 | 4 | 21 |
| β-strand | 229-230 | 2 | 19 |
| α-helix | 231-233 | 3 | |
| β-strand | 234-235 | 2 | 20 |
| β-strand | 241-242 | 2 | 20 |
| β-strand | 245-250 | 6 | 19 |
| β-strand | 259-262 | 4 | 21 |
| β-strand | 270-272 | 3 | 21 |
Chain G: 1 helix, 11 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 3 | 1 | 22 |
| β-strand | 6-11 | 6 | 23 |
| β-strand | 21-30 | 10 | 23 |
| β-strand | 31 | 1 | 22 |
| β-strand | 36-41 | 6 | 24 |
| β-strand | 45 | 1 | 24 |
| β-strand | 50-51 | 2 | 23 |
| β-strand | 55-56 | 2 | 23 |
| β-strand | 62-70 | 9 | 23 |
| β-strand | 78-83 | 6 | 24 |
| α-helix | 90 | 1 | |
| β-strand | 91-94 | 4 | 24 |
Chain I: 3 helices, 17 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 5 | 1 | 25 |
| β-strand | 10-14 | 5 | 26 |
| α-helix | 18 | 1 | |
| β-strand | 19-25 | 7 | 25 |
| β-strand | 32-44 | 8 | 26 |
| β-strand | 51-56 | 6 | 26 |
| β-strand | 66-68 | 3 | 25 |
| β-strand | 80-83 | 4 | 25 |
| β-strand | 85-91 | 7 | 25 |
| α-helix | 96-98 | 3 | |
| β-strand | 100-108 | 9 | 26 |
| β-strand | 120-125 | 6 | 26 |
| β-strand | 133-137 | 5 | 27 |
| β-strand | 139 | 1 | 28 |
| β-strand | 147-151 | 5 | 27 |
| β-strand | 168-169 | 2 | 27 |
| α-helix | 170-172 | 3 | |
| β-strand | 173 | 1 | 29 |
| β-strand | 186 | 1 | 29 |
| β-strand | 188-190 | 3 | 27 |
Chain J: 7 helices, 24 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 5 | 1 | 30 |
| β-strand | 10-14 | 5 | 31 |
| β-strand | 19-21 | 3 | 32 |
| β-strand | 24 | 1 | 30 |
| β-strand | 31-44 | 7 | 31 |
| β-strand | 50-56 | 7 | 31 |
| β-strand | 66-67 | 2 | 31 |
| β-strand | 77-79 | 3 | 32 |
| β-strand | 86 | 1 | 30 |
| β-strand | 88-91 | 4 | 32 |
| α-helix | 96-98 | 3 | |
| β-strand | 100-107 | 8 | 31 |
| β-strand | 113-114 | 2 | 31 |
| β-strand | 118-123 | 6 | 31 |
| α-helix | 126-128 | 3 | |
| β-strand | 130 | 1 | 33 |
| α-helix | 131-132 | 2 | |
| β-strand | 133-137 | 5 | 28 |
| α-helix | 138-140 | 3 | |
| α-helix | 143-145 | 3 | |
| β-strand | 149-159 | 11 | 28 |
| β-strand | 160 | 1 | 33 |
| β-strand | 166-170 | 5 | 34 |
| β-strand | 173-175 | 3 | 34 |
| β-strand | 179-181 | 3 | 28 |
| β-strand | 186-187 | 2 | 28 |
| α-helix | 195-196 | 2 | |
| β-strand | 197-206 | 10 | 28 |
| α-helix | 207-210 | 4 | |
| β-strand | 216-223 | 8 | 34 |
| β-strand | 242-249 | 8 | 34 |
8 more chain groups are not listed. Open the entry in the viewer and use the sequence panel to see them.
Molecules and chains
| Molecule | Chains | Type | Length | Organism | UniProt |
|---|
| H-2 class I histocompatibility antigen, D-B alpha chain | A, F, K, P | protein | 275 | Mus musculus | P01899 (AlphaFold model) |
| Beta-2-microglobulin | B, G, L, Q | protein | 99 | Mus musculus | P01887 (AlphaFold model) |
| 10-mer peptide from RNA-directed RNA polymerase | C, H, M, R | protein | 10 | synthetic construct | P13175 |
| T cell receptor alpha variable 21-DV12,T-cell receptor, sp3.4 alpha chain | D, I, N, S | protein | 195 | Mus musculus, Homo sapiens | A0A075B6C4 (AlphaFold model), K7N5N2 |
| T cell receptor beta, variable 29,Human nkt tcr beta chain | E, J, O, T | protein | 240 | Mus musculus, Homo sapiens | A0A0G2LB96, K7N5M4 |
Sequence of entity 1 (A, F, K, P), FASTA
>3PQY_1 H-2 class I histocompatibility antigen, D-B alpha chain (chains A, F, K, P)
PHSMRYFETAVSRPGLEEPRYISVGYVDNKEFVRFDSDAENPRYEPRAPWMEQEGPEYWE
RETQKAKGQEQWFRVSLRNLLGYYNQSAGGSHTLQQMSGCDLGSDWRLLRGYLQFAYEGR
DYIALNEDLKTWTAADMAAQITRRKWEQSGAAEHYKAYLEGECVEWLHRYLKNGNATLLR
TDSPKAHVTHHPRSKGEVTLRCWALGFYPADITLTWQLNGEELTQDMELVETRPAGDGTF
QKWASVVVPLGKEQNYTCRVYHEGLPEPLTLRWEP
Sequence of entity 2 (B, G, L, Q), FASTA
>3PQY_2 Beta-2-microglobulin (chains B, G, L, Q)
IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDW
SFYILAHTEFTPTETDTYACRVKHDSMAEPKTVYWDRDM
Sequence of entity 3 (C, H, M, R), FASTA
>3PQY_3 10-mer peptide from RNA-directed RNA polymerase (chains C, H, M, R)
SSLENFRAYV
Sequence of entity 4 (D, I, N, S), FASTA
>3PQY_4 T cell receptor alpha variable 21-DV12,T-cell receptor, sp3.4 alpha chain (chains D, I, N, S)
KTTQPDSMESTEGETVHLPCSHATISGNEYIYWYRQVPLQGPEYVTHGLQQNTTNSMAFL
AIASDRKSSTLILPHVSLRDAAVYHCILSGGSNYKLTFGKGTLLTVTPIQNPDPAVYQLR
DSKSSDKSVCLFTDFDSQTNVSQSKDSDVYITDKCVLDMRSMDFKSNSAVAWSNKSDFAC
ANAFNNSIIPEDTFF
Sequence of entity 5 (E, J, O, T), FASTA
>3PQY_5 T cell receptor beta, variable 29,Human nkt tcr beta chain (chains E, J, O, T)
DMKVTQMPRYLIKRMGENVLLECGQDMSHETMYWYRQDPGLGLQLIYISYDVDSNSEGDI
PKGYRVSRKKREHFSLILDSAKTNQTSVYFCASSFGREQYFGPGTRLTVLEDLKNVFPPE
VAVFEPSEAEISHTQKATLVCLATGFYPDHVELSWWVNGKEVHSGVCTDPQPLKEQPALN
DSRYALSSRLRVSATFWQNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEAWGRAD
Primary citation
Structural basis for enabling T-cell receptor diversity within biased virus-specific CD8+ T-cell responses. Day, E.B., Guillonneau, C., Gras, S. et al. Proc Natl Acad Sci U S A (2011) 108:9536-9541. DOI 10.1073/pnas.1106851108 · PubMed
Other PDB entries of the same protein (UniProt P01899 (AlphaFold model), which also has an AlphaFold model), best resolution first:
- 6WZY 1.5 Å, Structure of DbNA(10) peptides bound to H-2Db MHC-I
- 6X00 1.55 Å, Structure of DbNA(11) peptides bound to H-2Db MHC-I
- 7N9J 1.74 Å, Crystal structure of H2DB in complex with HSF2 melanoma neoantigen
- 5M02 1.75 Å, Crystal structure of murine P14 TCR / H-2Db with PF, modified gp33 peptide from LCMV
- 7N5Q 1.76 Å, Peptide-MHC complex of mouse H2-Db presenting PA224 with E4C mutation
- 7N4K 1.85 Å, 6218 TCR in complex with H2-Db PA 224
- 7N5C 1.87 Å, 6218 TCR in complex with H2Db PA with an engineered TCR-pMHC disulfide bond
- 6G9Q 1.89 Å, Ternary complex of P14 TCR with murine MHC class I H-2 Db in complex with self-antigen…
- 1WBX 1.9 Å, Crystal structures of murine MHC class I H-2 db and kb molecules in complex with ctl…
- 4L8D 1.9 Å, Crystal structure of the H2Db in complex with the NP-N5D peptide
- 3CC5 1.91 Å, H-2Db complex with human gp100
- 5M00 1.95 Å, Crystal structure of murine P14 TCR complex with H-2Db and Y4A, modified gp33 peptide…
Browse structure collections
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