1LVC: Adenylyl cyclase domain of anthrax edema factor
Crystal structure of the adenylyl cyclase domain of anthrax edema factor (EF) in complex with calmodulin and 2' deoxy, 3' anthraniloyl ATP. Determined by X-ray diffraction at 3.6 Å resolution. Released 4 Dec 2002.
- Method
- X-ray diffraction
- Resolution
- 3.6 Å
- Organisms
- Bacillus anthracis, Homo sapiens
- Chains
- 6
- Atoms
- 15,302
- Mol. weight
- 228.97 kDa
- Ligands
- CA, DOT, YB
- Released
- 4 Dec 2002
Explore 1LVC in 3D
Show helices and sheets
RCSB PDB
PDBe
Secondary structure: helices and β-sheets
1LVC contains 102 α-helices and 83 β-strands across 6 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.
Chain A: 25 helices, 24 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 296-297 | 2 | 1 |
| α-helix | 298-305 | 8 | |
| α-helix | 309-321 | 13 | |
| β-strand | 324-328 | 5 | 1 |
| α-helix | 333-340 | 8 | |
| α-helix | 343 | 1 | |
| β-strand | 344-345 | 2 | 2 |
| α-helix | 346 | 1 | |
| α-helix | 352-355 | 4 | |
| β-strand | 363 | 1 | 2 |
| β-strand | 365 | 1 | 3 |
| α-helix | 368-370 | 3 | |
| α-helix | 377-392 | 16 | |
| β-strand | 395 | 1 | 3 |
| β-strand | 398-402 | 5 | 3 |
| β-strand | 404 | 1 | 4 |
| α-helix | 407-416 | 10 | |
| β-strand | 420-426 | 7 | 5 |
| β-strand | 431-436 | 6 | 5 |
| β-strand | 442-447 | 6 | 5 |
| β-strand | 452 | 1 | 4 |
| β-strand | 453-457 | 5 | 5 |
| β-strand | 472-473 | 2 | 5 |
| α-helix | 474 | 1 | |
| β-strand | 475-481 | 7 | 3 |
| β-strand | 484-487 | 4 | 3 |
| β-strand | 488-489 | 2 | 2 |
| β-strand | 494-499 | 6 | 1 |
| β-strand | 500 | 1 | 6 |
| α-helix | 501-505 | 5 | |
| α-helix | 512-517 | 6 | |
| α-helix | 523-533 | 11 | |
| α-helix | 534-538 | 5 | |
| β-strand | 541-542 | 2 | 7 |
| β-strand | 548-549 | 2 | 7 |
| α-helix | 551-567 | 17 | |
| α-helix | 580-582 | 3 | |
| β-strand | 593-596 | 4 | 1 |
| β-strand | 602-605 | 4 | 1 |
| α-helix | 608-618 | 11 | |
| β-strand | 624 | 1 | 6 |
| α-helix | 648-653 | 6 | |
| α-helix | 660-668 | 9 | |
| α-helix | 696-704 | 9 | |
| α-helix | 707-709 | 3 | |
| α-helix | 714-736 | 23 | |
| α-helix | 745-767 | 23 | |
| α-helix | 774-778 | 5 | |
| α-helix | 788-796 | 9 | |
Chain B: 20 helices, 24 β-strands
| Element | Residues | Length | Sheet |
|---|
| β-strand | 297 | 1 | 8 |
| α-helix | 299-305 | 7 | |
| α-helix | 309-321 | 13 | |
| β-strand | 324-328 | 5 | 8 |
| α-helix | 333-340 | 8 | |
| β-strand | 344-345 | 2 | 9 |
| β-strand | 365 | 1 | 10 |
| α-helix | 368-370 | 3 | |
| α-helix | 377-392 | 16 | |
| β-strand | 398-402 | 5 | 10 |
| β-strand | 404 | 1 | 11 |
| α-helix | 409-415 | 7 | |
| β-strand | 420-426 | 7 | 12 |
| β-strand | 431-436 | 6 | 12 |
| β-strand | 442-447 | 6 | 12 |
| β-strand | 452 | 1 | 11 |
| β-strand | 453-457 | 5 | 12 |
| α-helix | 458 | 1 | |
| β-strand | 472-473 | 2 | 12 |
| β-strand | 475-481 | 7 | 10 |
| β-strand | 484-487 | 4 | 10 |
| β-strand | 488-489 | 2 | 9 |
| β-strand | 494-499 | 6 | 8 |
| β-strand | 500 | 1 | 13 |
| α-helix | 502-505 | 4 | |
| α-helix | 510-517 | 8 | |
| α-helix | 525-533 | 9 | |
| α-helix | 534-538 | 5 | |
| β-strand | 541-542 | 2 | 14 |
| β-strand | 548-549 | 2 | 14 |
| α-helix | 551-565 | 15 | |
| α-helix | 580-582 | 3 | |
| β-strand | 594-596 | 3 | 8 |
| β-strand | 602-604 | 3 | 8 |
| α-helix | 608-614 | 7 | |
| α-helix | 615-619 | 5 | |
| β-strand | 624 | 1 | 13 |
| β-strand | 635 | 1 | 15 |
| β-strand | 642 | 1 | 15 |
| α-helix | 648-651 | 4 | |
| α-helix | 714-727 | 14 | |
| α-helix | 728-730 | 3 | |
| α-helix | 743-764 | 22 | |
| α-helix | 786-790 | 5 | |
Chain C: 27 helices, 23 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 298-305 | 8 | |
| α-helix | 309-321 | 13 | |
| β-strand | 324-328 | 5 | 16 |
| α-helix | 329-330 | 2 | |
| α-helix | 333-340 | 8 | |
| α-helix | 343 | 1 | |
| β-strand | 344-345 | 2 | 17 |
| α-helix | 346 | 1 | |
| α-helix | 352-355 | 4 | |
| β-strand | 363 | 1 | 17 |
| β-strand | 365 | 1 | 18 |
| α-helix | 368-370 | 3 | |
| α-helix | 377-392 | 16 | |
| β-strand | 395 | 1 | 18 |
| β-strand | 398-402 | 5 | 18 |
| β-strand | 404 | 1 | 19 |
| α-helix | 407-416 | 10 | |
| β-strand | 420-426 | 7 | 20 |
| β-strand | 431-436 | 6 | 20 |
| β-strand | 442-447 | 6 | 20 |
| β-strand | 452 | 1 | 19 |
| β-strand | 453-457 | 5 | 20 |
| β-strand | 472-473 | 2 | 20 |
| α-helix | 474 | 1 | |
| β-strand | 475-481 | 7 | 18 |
| β-strand | 484-487 | 4 | 18 |
| β-strand | 488-489 | 2 | 17 |
| β-strand | 494-499 | 6 | 16 |
| β-strand | 500 | 1 | 21 |
| α-helix | 501-505 | 5 | |
| α-helix | 512-515 | 4 | |
| α-helix | 522-533 | 12 | |
| α-helix | 534-538 | 5 | |
| β-strand | 541-543 | 3 | 22 |
| β-strand | 547-549 | 3 | 22 |
| α-helix | 551-567 | 17 | |
| α-helix | 580-582 | 3 | |
| β-strand | 593-596 | 4 | 16 |
| β-strand | 602-605 | 4 | 16 |
| α-helix | 608-618 | 11 | |
| β-strand | 624 | 1 | 21 |
| α-helix | 648-651 | 4 | |
| α-helix | 653-655 | 3 | |
| α-helix | 661-669 | 9 | |
| α-helix | 696-704 | 9 | |
| α-helix | 707-709 | 3 | |
| α-helix | 714-736 | 23 | |
| α-helix | 745-765 | 21 | |
| α-helix | 774-778 | 5 | |
| α-helix | 787-796 | 10 | |
Chain D: 10 helices, 4 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 8-10 | 3 | |
| α-helix | 12-16 | 5 | |
| β-strand | 27-28 | 2 | 23 |
| α-helix | 32-36 | 5 | |
| α-helix | 45-55 | 11 | |
| β-strand | 62-63 | 2 | 23 |
| α-helix | 65-75 | 11 | |
| α-helix | 78-81 | 4 | |
| α-helix | 82-92 | 11 | |
| β-strand | 99-100 | 2 | 24 |
| α-helix | 102-110 | 9 | |
| α-helix | 118-128 | 11 | |
| β-strand | 136-137 | 2 | 24 |
| α-helix | 138-143 | 6 | |
Chains E and F: 10 helices, 4 β-strands
| Element | Residues | Length | Sheet |
|---|
| α-helix | 8-10 | 3 | |
| α-helix | 12-16 | 5 | |
| β-strand | 27-28 | 2 | 25 |
| α-helix | 32-36 | 5 | |
| α-helix | 45-55 | 11 | |
| β-strand | 62-63 | 2 | 25 |
| α-helix | 65-75 | 11 | |
| α-helix | 78-81 | 4 | |
| α-helix | 82-92 | 11 | |
| β-strand | 99-100 | 2 | 26 |
| α-helix | 102-110 | 9 | |
| α-helix | 118-128 | 11 | |
| β-strand | 136-137 | 2 | 26 |
| α-helix | 138-146 | 9 | |
Molecules and chains
| Molecule | Chains | Type | Length | Organism | UniProt |
|---|
| calmodulin-sensitive adenylate cyclase | A, B, C | protein | 510 | Bacillus anthracis | P40136 (AlphaFold model) |
| calmodulin | D, E, F | protein | 149 | Homo sapiens | P0DP23 (AlphaFold model) |
Sequence of entity 1 (A, B, C), FASTA
>1LVC_1 calmodulin-sensitive adenylate cyclase (chains A, B, C)
DRIDVLKGEKALKASGLVPEHADAFKKIARELNTYILFRPVNKLATNLIKSGVATKGLNV
HGKSSDWGPVAGYIPFDQDLSKKHGQQLAVEKGNLENKKSITEHEGEIGKIPLKLDHLRI
EELKENGIILKGKKEIDNGKKYYLLESNNQVYEFRISDENNEVQYKTKEGKITVLGEKFN
WRNIEVMAKNVEGVLKPLTADYDLFALAPSLTEIKKQIPQKEWDKVVNTPNSLEKQKGVT
NLLIKYGIERKPDSTKGTLSNWQKQMLDRLNEAVKYTGYTGGDVVNHGTEQDNEEFPEKD
NEIFIINPEGEFILTKNWEMTGRFIEKNITGKDYLYYFNRSYNKIAPGNKAYIEWTDPIT
KAKINTIPTSAEFIKNLSSIRRSSNVGVYKDSGDKDEFAKKESVKKIAGYLSDYYNSANH
IFSQEKKRKISIFRGIQAYNEIENVLKSKQIAPEYKNYFQYLKERITNQVQLLLTHQKSN
IEFKLLYKQLNFTENETDNFEVFQKIIDEK
Sequence of entity 2 (D, E, F), FASTA
>1LVC_2 calmodulin (chains D, E, F)
MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADG
NGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDE
EVDEMIREADIDGDGQVNYEEFVQMMTAK
Ligands and cofactors
| ID | Name | Formula | Copies |
|---|
| CA | Calcium ion | Ca | 6 |
| DOT | 3'ANTHRANILOYL-2'-deoxy-adenosine-5'-triphosphate | C17 H21 N6 O13 P3 | 2 |
| YB | Ytterbium (III) ion | Yb | 3 |
Primary citation
Physiological calcium concentrations regulate calmodulin binding and catalysis of adenylyl cyclase exotoxins. Shen, Y., Lee, Y.-S., Soelaiman, S. et al. EMBO J (2002) 21:6721-6732. DOI 10.1093/emboj/cdf681 · PubMed
Other PDB entries of the same protein (UniProt P40136 (AlphaFold model), which also has an AlphaFold model), best resolution first:
- 1K8T 2.6 Å, Crystal structure of the adenylyl cyclase domain of anthrax edema factor (EF)
- 1K90 2.75 Å, Crystal structure of the adenylyl cyclase domain of anthrax edema factor (EF) in complex…
- 1K93 2.95 Å, Crystal structure of the adenylyl cyclase domain of anthrax edema factor (EF) in complex…
- 1S26 3.0 Å, Structure of Anthrax Edema Factor-Calmodulin-alpha,beta-methyleneadenosine…
- 1SK6 3.2 Å, Crystal structure of the adenylyl cyclase domain of anthrax edema factor (EF) in complex…
- 1XFX 3.2 Å, Crystal structure of anthrax edema factor (EF) in complex with calmodulin in the…
- 6UZB 3.2 Å, Anthrax toxin protective antigen channels bound to edema factor
- 1XFZ 3.25 Å, Crystal structure of anthrax edema factor (EF) in complex with calmodulin in the…
- 1PK0 3.3 Å, Crystal Structure of the EF3-CaM complexed with PMEApp
- 1XFY 3.3 Å, Crystal structure of anthrax edema factor (EF) in complex with calmodulin
- 6VRA 3.3 Å, Anthrax octamer prechannel bound to full-length edema factor
- 1XFU 3.35 Å, Crystal structure of anthrax edema factor (EF) truncation mutant, EF-delta 64 in complex…
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