9NVQ
Structure of Nanchung-Inactive-Calmodulin in complex with Afidopyropen and calcium
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, E (B, D) | Inactive | polymer | 984 | 109382.0 | 2 | UniProt (A0A9P0MRC5) UniProt (A0A9P0HI19) Pfam (PF00023) Pfam (PF12796) Pfam (PF00520) | Halyomorpha halys (brown marmorated stink bug) | |
| 2 | B, D (E, F) | Calmodulin-1 | polymer | 74 | 8168.0 | 2 | UniProt (P0DP23) Pfam (PF13499) | Homo sapiens (human) | |
| 3 | C, F (A, C) | Nanchung | polymer | 882 | 101194.9 | 2 | Halyomorpha halys | ||
| 4 | AA, BA, G, H, HA... (D, B, C, A) | [(2~{R})-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] (~{Z})-octadec-9-enoate | non-polymer | 718.0 | 12 | Chemie (6OU) PubChem (23727968) PubChem (3246975) PubChem (5282290) PubChem (5283496) PubChem (5785226) PubChem (123931) PubChem (90470676) PubChem (92863393) | |||
| 5 | CA, DA, K, L, N... (D, B) | 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine | non-polymer | 760.1 | 6 | Chemie (LBN) | |||
| 6 | EA, M (D, B) | Afidopyropen | non-polymer | 593.7 | 2 | Chemie (A1B32) | |||
| 7 | FA, P, Q, R, V... (C, E, A, F) | CALCIUM ION | non-polymer | 40.1 | 6 | Chemie (CA) PubChem (271) | |||
| 8 | GA, S (C, A) | (2~{S})-2-azanyl-3-[[(2~{R})-3-hexadecanoyloxy-2-[(~{Z})-octadec-9-enoyl]oxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid | non-polymer | 762.0 | 2 | Chemie (D39) PubChem (5282292) PubChem (5283499) PubChem (5771747) PubChem (71768570) PubChem (122264) PubChem (73027703) PubChem (11607406) PubChem (102261856) PubChem (9853619) PubChem (13743808) |
Sequence modifications
B, D: -13 - 16 (PDB: 9NVQ)
B, D: 31 - 92 (UniProt: A0A9P0MRC5)
B, D: 93 - 984 (UniProt: A0A9P0HI19)
B, D: 31 - 92 (UniProt: A0A9P0MRC5)
B, D: 93 - 984 (UniProt: A0A9P0HI19)
| PDB | External Database | Details |
|---|---|---|
| Gln 254 | His 172 | conflict |
| Ile 401 | Leu 319 | conflict |
| Ile 427 | Val 345 | conflict |
| Leu 445 | Ile 363 | conflict |
| Val 480 | Ile 398 | conflict |
| Ile 487 | Met 405 | conflict |
| Val 607 | Ile 525 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 6 |
| Total formula weight | 437489.7 | |
| Non-Polymers* | Number of molecules | 28 |
| Total formula weight | 16128.2 | |
| All* | Total formula weight | 453617.9 |
