8VAU
Nicotinamide Riboside and CD38: Covalent Inhibition and Live-Cell Labeling
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 | polymer | 257 | 29763.7 | 2 | UniProt (P28907) Pfam (PF02267) | Homo sapiens (human) | 2'-phospho-ADP-ribosyl cyclase,2'-phospho-ADP-ribosyl cyclase/2'-phospho-cyclic-ADP-ribose transferase,2'-phospho-cyclic-ADP-ribose transferase,ADP-ribosyl cyclase 1,ADPRC 1,Cyclic ADP-ribose hydrolase 1,cADPr hydrolase 1,T10 |
| 2 | C, E (A, B) | Nicotinamide riboside | non-polymer | 255.2 | 2 | Chemie (NNR) | |||
| 3 | D, F (A, B) | alpha-D-ribofuranose | non-polymer | 150.1 | 2 | Chemie (RIB) | |||
| 4 | G, H (A, B) | water | water | 18.0 | 300 | Chemie (HOH) |
Sequence modifications
A, B: 45 - 300 (UniProt: P28907)
| PDB | External Database | Details |
|---|---|---|
| Ser 44 | - | expression tag |
| Asp 100 | Asn 100 | engineered mutation |
| Ala 164 | Asn 164 | engineered mutation |
| Asp 209 | Asn 209 | engineered mutation |
| Asp 219 | Asn 219 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 59527.5 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 810.8 | |
| All* | Total formula weight | 60338.2 |
