4QFS
Structure of AMPK in complex with Br2-A769662core activator and STAUROSPORINE inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | 5'-AMP-activated protein kinase catalytic subunit alpha-1 | polymer | 503 | 57779.1 | 1 | UniProt (P54645) Pfam (PF00069) Pfam (PF21147) Pfam (PF16579) | Rattus norvegicus (brown rat rat rats) | AMPK subunit alpha-1, Acetyl-CoA carboxylase kinase, ACACA kinase, Hydroxymethylglutaryl-CoA reductase kinase, HMGCR kinase, Tau-protein kinase PRKAA1 |
| 2 | B (B) | 5'-AMP-activated protein kinase subunit beta-1 | polymer | 204 | 23045.3 | 1 | UniProt (P80386) Pfam (PF16561) Pfam (PF04739) | Rattus norvegicus (brown rat rat rats) | AMPK subunit beta-1, AMPKb, 5'-AMP-activated protein kinase 40 kDa subunit |
| 3 | C (C) | 5'-AMP-activated protein kinase subunit gamma-1 | polymer | 330 | 37434.1 | 1 | UniProt (P80385) Pfam (PF00571) | Rattus norvegicus (brown rat rat rats) | AMPK gamma1, AMPK subunit gamma-1, AMPKg |
| 4 | D (A) | STAUROSPORINE | non-polymer | 466.5 | 1 | Chemie (STU) PubChem (5279) PubChem (71203703) PubChem (42610657) PubChem (44259) PubChem (44299148) PubChem (49831000) PubChem (25322871) PubChem (28684983) PubChem (44120114) PubChem (44537813) PubChem (46864193) PubChem (68262703) PubChem (68306294) PubChem (451705) PubChem (73953205) PubChem (86306248) PubChem (358479) PubChem (5280487) PubChem (5459111) PubChem (5311103) PubChem (6711321) PubChem (9956178) PubChem (6419748) PubChem (9804568) PubChem (122130844) PubChem (12046017) PubChem (9937179) PubChem (143163481) PubChem (143224059) PubChem (143494026) PubChem (162978898) | |||
| 5 | E (A) | 2-bromo-3-(4-bromophenyl)-4-hydroxy-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carbonitrile | non-polymer | 426.1 | 1 | Chemie (32H) PubChem (76871925) | |||
| 6 | F, G, H, I, J (A, B) | CHLORIDE ION | non-polymer | 35.5 | 5 | Chemie (CL) PubChem (312) | |||
| 7 | K (C) | ADENOSINE MONOPHOSPHATE | non-polymer | 347.2 | 1 | Chemie (AMP) PubChem (16397049) PubChem (16760266) PubChem (224) PubChem (40467049) PubChem (40469468) PubChem (34768) PubChem (44348067) PubChem (83862) PubChem (45358029) PubChem (46874558) PubChem (40459109) PubChem (57358045) PubChem (57879893) PubChem (57879902) PubChem (46875232) PubChem (446048) PubChem (515384) PubChem (638042) PubChem (177678969) PubChem (6083) PubChem (1549371) PubChem (5316444) PubChem (92144436) PubChem (5742864) PubChem (122197642) PubChem (12358354) PubChem (12163610) PubChem (12358355) PubChem (162290139) PubChem (162946266) PubChem (171699505) | |||
| 8 | L, M (C) | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) |
Sequence modifications
A: 0 - 468 (UniProt: P54645)
A: 525 - 548 (UniProt: P54645)
B: 68 - 270 (UniProt: P80386)
| PDB | External Database | Details |
|---|---|---|
| Gly -1 | - | expression tag |
| PDB | External Database | Details |
|---|---|---|
| Ala 517 | - | SEE REMARK 999 |
| Ser 518 | - | SEE REMARK 999 |
| Gly 519 | - | SEE REMARK 999 |
| Gly 520 | - | SEE REMARK 999 |
| Pro 521 | - | SEE REMARK 999 |
| Gly 522 | - | SEE REMARK 999 |
| Gly 523 | - | SEE REMARK 999 |
| Ser 524 | - | SEE REMARK 999 |
| PDB | External Database | Details |
|---|---|---|
| Met 67 | - | expression tag |
| Asp 108 | Ser 108 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 118258.5 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 1609.2 | |
| All* | Total formula weight | 119867.7 |
