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MolNFT v1 · #16222 · protein

Solution structure of rabbit apo-S100A11 (19 models)

1NSH · Calgizzarin: “Solution structure of rabbit apo-S100A11 (19 models)”. Solution nmr, 1 pocket (best druggability 0.35). MolNFT v1 #16222 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1NSH
Type
protein
Length
202 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Calgizzarin
UniProt
P24480
Pockets
1 · best druggability 0.35

Structure

solution nmr · 1 distinct chain · 59% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCalgizzarinprotein10159% helix, 2% strandP24480

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11080.350.7325empty

Interfaces

1 interface between chains.

  • A–B · 1523 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 1NSH · Solution Structure of Rabbit apo-S100A11 (19 models) · the same entry in another collection · chain A against A, TM-score 1.00
  • P24480 · AlphaFold monomer V2.0 prediction for protein S100-A11 (P24480) · a predicted model of the same protein · chain A against A, TM-score 0.63

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