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Structure of SWI/SNF chromatin remodeler rsc bound to a nucleosome

Analyse Structure of SWI/SNF chromatin remodeler rsc bound to a nucleosome in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6TDA
Type
protein + DNA
Length
5,137 residues
Chains
23
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3.2; Histone H4; Histone H2A; Histone H2B 1.1; DNA-I; DNA-J; Chromatin…
EC
3.6.4.12
UniProt
P84233, P62799, Q6AZJ8, P02281, Q06168, P43609, P32832, Q03124, P25632, Q07979, Q9URQ5, Q02206, P32597, Q12406, Q05123, P53330
Ligands
ZN
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 21 distinct chains · 45% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone H3.2protein9667% helix, 4% strandP84233
BHistone H4protein8757% helix, 8% strandP62799
C, GHistone H2Aprotein10257% helix, 6% strandQ6AZJ8
D, HHistone H2B 1.1protein9273% helix, 4% strandP02281
EHistone H3.2protein9569% helix, 4% strandP84233
FHistone H4protein8262% helix, 7% strandP62799
IDNA-Idna160——
JDNA-Jdna160——
KChromatin structure-remodeling complex subunit SFH1protein23540% helix, 14% strandQ06168
LChromatin structure-remodeling complex protein RSC8, chromatin structure-remodeling complex protein RSC8protein59652% helix, 7% strandP43609
MChromatin structure-remodeling complex subunit RSC7protein10832% helix, 19% strandP32832
NChromatin structure-remodeling complex subunit RSC9protein36754% helix, 0% strandQ03124
OChromatin structure-remodeling complex protein RSC6protein21250% helix, 4% strandP25632
PChromatin structure-remodeling complex protein RSC58protein34737% helix, 12% strandQ07979
QHigh temperature lethal protein 1protein5866% helix, 5% strandQ9URQ5
RChromatin structure-remodeling complex subunit RSC4protein1314% helix, 44% strandQ02206
SNuclear protein STH1/NPS1 (EC 3.6.4.12)protein78352% helix, 8% strandP32597
TActin-related protein 7protein39946% helix, 19% strandQ12406
UActin-like protein ARP9protein39640% helix, 19% strandQ05123
VRegulator of TY1 transposition protein 102protein5413% helix, 28% strandP53330
XUnknown proteinprotein38317% helix, 7% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · chains L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111210.870.88123empty
23530.840.9345empty
39630.810.82108empty
47600.800.8484empty
510430.800.8181empty

Interfaces

76 interfaces between chains.

  • I–J · 7190 Ų buried · 590 hydrogen bonds · nucleic-nucleic
  • P–S · 4955 Ų buried · 46 hydrogen bonds · protein-protein
  • P–X · 4337 Ų buried · 32 hydrogen bonds · protein-protein
  • L–O · 4078 Ų buried · 32 hydrogen bonds · protein-protein
  • L–M · 3759 Ų buried · 42 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 modified (engineered).

Compared structures

  • 6TDA · Structure of SWI/SNF chromatin remodeler RSC bound to a nucleosome · the same entry in another collection · chain J against J, TM-score 1.00

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