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MolNFT v1 · #178296 · protein

De novo design protein D53 with mbp tag

7FBD · Maltodextrin-binding PROTEIN,DE novo design protein D53: “De novo design protein D53 with mbp tag”. X-ray diffraction, 8 pockets (best druggability 0.69). MolNFT v1 #178296 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7FBD
Type
protein
Length
894 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Maltodextrin-binding PROTEIN,DE novo design protein D53
UniProt
A0A4P1LXE0
Pockets
8 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 50% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BMaltodextrin-binding PROTEIN,DE novo design protein D53protein44451% helix, 18% strandA0A4P1LXE0
AMaltodextrin-binding PROTEIN,DE novo design protein D53protein45049% helix, 16% strandA0A4P1LXE0

Pockets

8 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16380.690.7762empty
25220.670.7762empty
35580.660.7766empty
4960.470.8022empty
51170.460.7819empty

Interfaces

1 interface between chains.

  • B–A · 436 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 7FBD · De novo design protein D53 with MBP tag · the same entry in another collection · chain B against B, TM-score 1.00

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