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The pointed end complex of dynactin bound to BICDR1

Analyse The pointed end complex of dynactin bound to BICDR1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7Z8M
Type
protein
Length
2,272 residues
Chains
9
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dynactin subunit 2; Bicd family-like cargo adapter 1; Dynactin 6; Dynactin subunit 4…
UniProt
A0A4X1W6J2, A0JNT9, D0G6S1, A0A4X1TB62, I3LHK5, F2Z5G5, Q6QAQ1, A0A286ZK88
Ligands
ADP, ATP, MG, ZN
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 9 distinct chains · 33% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
MDynactin subunit 2protein2413% helix, 13% strandA0A4X1W6J2
XBicd family-like cargo adapter 1protein1573% helix, 0% strandA0JNT9
UDynactin 6protein1788% helix, 25% strandD0G6S1
YDynactin subunit 4protein38319% helix, 28% strandA0A4X1TB62
JARP11protein37941% helix, 18% strandI3LHK5
GARP1 actin related protein 1 homolog aprotein36941% helix, 20% strandF2Z5G5
HActin, cytoplasmic 1protein37245% helix, 20% strandQ6QAQ1
VDynactin subunit 5protein1829% helix, 35% strandA0A286ZK88
IARP1 actin related protein 1 homolog aprotein37042% helix, 20% strandF2Z5G5

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 3 copies · chains G, H, I
  • ATP · Adenosine-5'-triphosphate · ligand · chains Y, J
  • MG · Magnesium ion · metal · 4 copies · chains J, G, H, I
  • ZN · Zinc ion · metal · 3 copies · chains Y

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 16 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111530.810.8284empty
27200.800.8478ATP, MG
36240.790.8474empty
49550.760.7967empty
54670.760.8463ADP, MG

Interfaces

14 interfaces between chains.

  • Y–J · 3059 Ų buried · 25 hydrogen bonds · protein-protein
  • Y–V · 1681 Ų buried · 8 hydrogen bonds · protein-protein
  • J–I · 1285 Ų buried · 18 hydrogen bonds · protein-protein
  • J–H · 1174 Ų buried · 10 hydrogen bonds · protein-protein
  • G–I · 1145 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7Z8M · The pointed end complex of dynactin bound to BICDR1 · the same entry in another collection · chain I against I, TM-score 1.00
  • Q6QAQ1 · AlphaFold monomer V2.0 prediction for actin, cytoplasmic 1 (Q6QAQ1) · a predicted model of the same protein · chain H against A, TM-score 0.96
  • A0JNT9 · AlphaFold monomer V2.0 prediction for bicd family-like cargo adapter 1 (A0JNT9) · a predicted model of the same protein · chain X against A, TM-score 0.77

Analyse

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