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MolNFT v1 · #153343 · protein

Cryo-EM structure of human lysosomal cobalamin exporter ABCD4

6JBJ · ATP-binding cassette sub-family D member 4: “Cryo-EM structure of human lysosomal cobalamin exporter ABCD4”. Electron microscopy, 1 ligand (ATP), 11 pockets (best druggability 0.84). MolNFT v1 #153343 on GenesisL1: 3D structure…

PDB
6JBJ
Type
protein
Length
1,130 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP-binding cassette sub-family D member 4
UniProt
O14678
Ligands
ATP
Pockets
11 · best druggability 0.84

Structure

electron microscopy · 1 distinct chain · 57% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BATP-binding cassette sub-family D member 4protein56557% helix, 4% strandO14678

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 2 copies · chains A, B

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

Pockets

11 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12980.840.9435empty
29180.790.8167empty
36750.780.8380ATP
46740.770.8285ATP
51810.480.7527empty

Interfaces

1 interface between chains.

  • A–B · 8251 Ų buried · 105 hydrogen bonds · protein-protein

Compared structures

  • 6JBJ · Cryo-EM structure of human lysosomal cobalamin exporter ABCD4 · the same entry in another collection · chain A against A, TM-score 1.00
  • O14678 · AlphaFold monomer V2.0 prediction for lysosomal cobalamin transporter ABCD4 (O14678) · a predicted model of the same protein · chain A against A, TM-score 0.93

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