GL1X · GenesisL1 explorer

MolNFT v1 · #126374 · protein

Synthetic nanobody in complex with mbp

5M15 · Maltose-binding periplasmic protein: “Synthetic nanobody in complex with mbp”. X-ray diffraction, 9 pockets (best druggability 0.79). MolNFT v1 #126374 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5M15
Type
protein
Length
985 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Maltose-binding periplasmic protein; Synthetic nanobody L2_D09, (a-MBP#3)
UniProt
P0AEX9
Pockets
9 · best druggability 0.79

Structure

x-ray diffraction · 4 distinct chains · 35% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMaltose-binding periplasmic proteinprotein36645% helix, 19% strandP0AEX9
BMaltose-binding periplasmic proteinprotein36745% helix, 21% strandP0AEX9
CSynthetic nanobody L2_D09, (a-MBP#3)protein1272% helix, 50% strand—
DSynthetic nanobody L2_D09, (a-MBP#3)protein12510% helix, 50% strand—

Pockets

9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16890.790.8477empty
27790.710.7794empty
32730.680.8330empty
42430.550.7741empty
5890.530.8424empty

Interfaces

5 interfaces between chains.

  • A–C · 1194 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 606 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 188 Ų buried · 3 hydrogen bonds · protein-protein
  • B–D · 187 Ų buried · 2 hydrogen bonds · protein-protein
  • A–D · 46 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5M15 · Synthetic nanobody in complex with MBP · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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