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MolNFT v1 · #91296 · protein

BRR2 helicase region S1087L

4F92 · U5 small nuclear ribonucleoprotein 200 kda helicase: “BRR2 helicase region S1087L”. X-ray diffraction, 1 ligand (SAN), 20 pockets (best druggability 0.85). MolNFT v1 #91296 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4F92
Type
protein
Length
1,723 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
U5 small nuclear ribonucleoprotein 200 kda helicase
EC
3.6.4.13
UniProt
O75643
Ligands
SAN
Pockets
20 · best druggability 0.85

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BU5 small nuclear ribonucleoprotein 200 kda helicase (EC 3.6.4.13)protein172342% helix, 17% strandO75643

Ligands and binding sites

  • SAN · Sulfanilamide · ligand · chains B

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

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17240.850.88102SAN
2830.750.9821empty
37380.740.8050empty
44030.740.8447empty
5960.730.9519empty

Compared structures

  • 4F92 · Brr2 Helicase Region S1087L · the same entry in another collection · chain B against B, TM-score 1.00

Analyse

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