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Crystal structure of the human rgma-BMP2 complex

Analyse Crystal structure of the human rgma-BMP2 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4UHY
Type
protein
Length
273 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bone morphogenetic protein 2; Repulsive guidance molecule a
UniProt
P12643, Q96B86
Pockets
3 · best druggability 0.60

Structure

x-ray diffraction · 3 distinct chains · 28% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABone morphogenetic protein 2protein10416% helix, 46% strandP12643
BBone morphogenetic protein 2protein10516% helix, 46% strandP12643
CRepulsive guidance molecule aprotein6467% helix, 0% strandQ96B86

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12650.600.7944empty
21450.460.7729empty
3520.260.7314empty

Interfaces

3 interfaces between chains.

  • A–B · 1332 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 549 Ų buried · 1 hydrogen bond · protein-protein
  • A–C · 482 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 4UHY · Crystal structure of the human RGMA-BMP2 complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96B86 · AlphaFold monomer V2.0 prediction for repulsive guidance molecule a (Q96B86) · a predicted model of the same protein · chain C against A, TM-score 0.91
  • P12643 · AlphaFold monomer V2.0 prediction for bone morphogenetic protein 2 (P12643) · a predicted model of the same protein · chain A against A, TM-score 0.91

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