6SMA
Crystal structure of Human Neutrophil Elastase (HNE) in complex with the 3-Oxo-beta-Sultam inhibitor LMC249
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C | Neutrophil elastase | polymer | 218 | 23319.0 | 3 | UniProt (P08246) Pfam (PF00089) In PDB | Homo sapiens (Human) | Bone marrow serine protease,Elastase-2,Human leukocyte elastase,HLE,Medullasin,PMN elastase |
| 2 | D, E, F, H, I | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 570.5 | 5 | In PDB GlyTouCan (G21290RB) | |||
| 3 | G | alpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 367.3 | 1 | In PDB GlyTouCan (G86851RC) | |||
| 4 | A, B, C | BROMIDE ION | non-polymer | 79.9 | 5 | Chemie (BR) | |||
| 5 | C | 3-[[1-[(4-bromophenyl)methyl]-1,2,3-triazol-4-yl]methylcarbamoyl]pentane-3-sulfonic acid | non-polymer | 445.3 | 1 | Chemie (LKK) | |||
| 6 | C | 1,2-ETHANEDIOL | non-polymer | 62.1 | 2 | Chemie (EDO) | |||
| 7 | water | water | 18.0 | 110 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 69956.9 | |
| Branched | Number of molecules | 6 |
| Total formula weight | 3220.1 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 969.0 | |
| All* | Total formula weight | 74146.0 |
