6MJ6
Crystal structure of the mCD1d/xxx (JJ166) /iNKTCR ternary complex
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | C | T cell receptor alpha variable 11,T cell receptor alpha variable 11,T cell receptor alpha joining 18,Human nkt tcr alpha chain, CHIMERIC PROTEIN,Human nkt tcr alpha chain | polymer | 209 | 23055.6 | 1 | UniProt (A0A0B4J1J9) UniProt (K7N5M3) Pfam (PF07686) Pfam (PF09291) In PDB | Mus musculus (Mouse) | T cell receptor alpha variable 11D, Human nkt tcr beta chain |
2 | D | Beta-chain,T cell receptor chain,T cell receptor beta constant 2, CHIMERIC PROTEIN | polymer | 241 | 27027.0 | 1 | UniProt (A2NTY6) UniProt (A0N8J3) UniProt (A0A5B9) Pfam (PF07686) Pfam (PF07654) In PDB | Mus musculus (Mouse) | |
3 | A | Antigen-presenting glycoprotein CD1d1 | polymer | 285 | 32632.7 | 1 | UniProt (A0A0R4J090) Pfam (PF16497) Pfam (PF07654) UniProt (by SIFTS) (P11609) In PDB | Mus musculus (Mouse) | MCG3074,isoform CRA_a |
4 | B | Beta-2-microglobulin | polymer | 99 | 11660.4 | 1 | UniProt (P01887) Pfam (PF07654) In PDB | Mus musculus (Mouse) | |
5 | E | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 424.4 | 1 | In PDB GlyTouCan (G42666HT) | |||
6 | F | beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 732.7 | 1 | In PDB GlyTouCan (G32152BH) | |||
7 | C, D, A, B | GLYCEROL | non-polymer | 92.1 | 7 | Chemie (GOL) | |||
8 | C, D, A | SODIUM ION | non-polymer | 23.0 | 3 | Chemie (NA) | |||
9 | A | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 1 | Chemie (NAG) | |||
10 | A | N-[(2S,3S,4R)-1-({4-O-[(4-chlorophenyl)methyl]-alpha-D-galactopyranosyl}oxy)-3,4-dihydroxyoctadecan-2-yl]hexacosanamide | non-polymer | 982.9 | 1 | Chemie (JTM) | |||
11 | water | water | 18.0 | 267 | Chemie (HOH) |
Sequence modifications
C: 1 - 92 (UniProt: A0A0B4J1J9)
C: 93 - 112 (PDB: 6MJ6)
C: 114 - 208 (UniProt: K7N5M3)
D: 0 - 94 (UniProt: A2NTY6)
D: 99 - 130 (UniProt: A0N8J3)
D: 131 - 240 (UniProt: A0A5B9)
A: 1 - 279 (UniProt: A0A0R4J090)
PDB | External Database | Details |
---|---|---|
Met 0 | - | initiating methionine |
Ile 113 | - | linker |
C: 114 - 208 (UniProt: K7N5M3)
D: 0 - 94 (UniProt: A2NTY6)
PDB | External Database | Details |
---|---|---|
Asp 95 | - | linker |
Glu 96 | - | linker |
Gly 97 | - | linker |
Tyr 98 | - | linker |
PDB | External Database | Details |
---|---|---|
Ala 130 | Ala 127 | linker |
PDB | External Database | Details |
---|---|---|
Cys 168 | Ser 56 | variant |
Ser 186 | Cys 74 | variant |
PDB | External Database | Details |
---|---|---|
His 280 | - | expression tag |
His 281 | - | expression tag |
His 282 | - | expression tag |
His 283 | - | expression tag |
His 284 | - | expression tag |
His 285 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 4 |
Total formula weight | 94375.6 | |
Branched | Number of molecules | 2 |
Total formula weight | 1157.1 | |
Non-Polymers* | Number of molecules | 12 |
Total formula weight | 1917.7 | |
All* | Total formula weight | 97450.4 |