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MolNFT v1 · #78624 · protein

Crystal structure of the MYOSTATIN:FOLLISTATIN-like 3 complex

3SEK · GROWTH/DIFFERENTIATION factor 8: “Crystal structure of the MYOSTATIN:FOLLISTATIN-like 3 complex”. X-ray diffraction, 1 ligand (NAG), 3 pockets (best druggability 0.68). MolNFT v1 #78624 on GenesisL1: 3D structure, binding sites and…

PDB
3SEK
Type
protein
Length
310 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GROWTH/DIFFERENTIATION factor 8; Follistatin-related protein 3
UniProt
O08689, O95633
Ligands
NAG
Pockets
3 · best druggability 0.68

Structure

x-ray diffraction · 2 distinct chains · 13% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BGROWTH/DIFFERENTIATION factor 8protein1097% helix, 44% strandO08689
CFollistatin-related protein 3protein20115% helix, 24% strandO95633

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16280.680.7773empty
2660.470.8417empty
3560.340.7815empty

Interfaces

1 interface between chains.

  • B–C · 1544 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 17 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 3SEK · Crystal Structure of the Myostatin:Follistatin-like 3 Complex · the same entry in another collection · chain B against B, TM-score 1.00
  • O95633 · AlphaFold monomer V2.0 prediction for follistatin-related protein 3 (O95633) · a predicted model of the same protein · chain C against A, TM-score 0.98
  • O08689 · AlphaFold monomer V2.0 prediction for GROWTH/DIFFERENTIATION factor 8 (O08689) · a predicted model of the same protein · chain B against A, TM-score 0.79

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