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MolNFT v1 · #142834 · protein + RNA

The cryo-EM structure of the precusor of human pre-catalytic spliceosome (pre-B complex)

6AH0 · U5SNRNA: “The cryo-EM structure of the precusor of human pre-catalytic spliceosome (pre-B complex)”. Electron microscopy, 3 ligands (IHP, GTP, MG), 20 pockets (best druggability 0.75). MolNFT v1 #142834 on GenesisL1: 3D structure…

PDB
6AH0
Type
protein + RNA
Length
13,870 residues
Chains
57
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
U5SNRNA; U5 small nuclear ribonucleoprotein 200 kda helicase; U5 small nuclear…
EC
3.6.4.13
UniProt
O75643, Q96DI7, P62316, P62306, P62304, P62308, P62318, P14678, P62314, Q9Y333, P62310, Q9Y4Z0, Q9Y4Y9, P62312, Q9UK45, O95777, P09661, P08579, Q15459, Q15428, Q12874, O75533, Q13435, Q15393, Q15427, Q9Y3B4, Q7RTV0, Q9BWJ5, O43395, O43172, O94906, Q8WWY3, P55769, P83876, Q53GS9, Q9BUQ8, Q6P2Q9, Q15029
Ligands
IHP, GTP, MG
Pockets
20 · best druggability 0.75

Structure

electron microscopy · 56 distinct chains · 36% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BU5SNRNArna115——
DU5 small nuclear ribonucleoprotein 200 kda helicase (EC 3.6.4.13)protein187445% helix, 16% strandO75643
EU5 small nuclear ribonucleoprotein 40 kda proteinprotein2990% helix, 49% strandQ96DI7
aSmall nuclear ribonucleoprotein sm D2protein7814% helix, 47% strandP62316
bSmall nuclear ribonucleoprotein Fprotein7314% helix, 52% strandP62306
c, RSmall nuclear ribonucleoprotein Eprotein788% helix, 44% strandP62304
dSmall nuclear ribonucleoprotein Gprotein6912% helix, 46% strandP62308
eSmall nuclear ribonucleoprotein sm D3protein7810% helix, 49% strandP62318
fSmall nuclear ribonucleoprotein-associated proteins B and B'protein640% helix, 56% strandP14678
gSmall nuclear ribonucleoprotein sm D1protein9319% helix, 40% strandP62314
FU6SNRNArna69——
qU6 snrna-associated sm-like protein LSM2protein9026% helix, 36% strandQ9Y333
rU6 snrna-associated sm-like protein LSM3protein758% helix, 57% strandP62310
sU6 snrna-associated sm-like protein LSM4protein7420% helix, 49% strandQ9Y4Z0
tU6 snrna-associated sm-like protein LSM5protein7513% helix, 48% strandQ9Y4Y9
xU6 snrna-associated sm-like protein LSM6protein7010% helix, 50% strandP62312
yU6 snrna-associated sm-like protein LSM7protein655% helix, 55% strandQ9UK45
zU6 snrna-associated sm-like protein LSM8protein6110% helix, 61% strandO95777
GPre-mRNArna42——
HU2SNRNArna109——
oU2 small nuclear ribonucleoprotein a'protein16227% helix, 17% strandP09661
pU2 small nuclear ribonucleoprotein B''protein9432% helix, 24% strandP08579
hSmall nuclear ribonucleoprotein sm D3protein8014% helix, 49% strandP62318
iSmall nuclear ribonucleoprotein-associated proteins B and B'protein7310% helix, 55% strandP14678
jSmall nuclear ribonucleoprotein sm D1protein8216% helix, 45% strandP62314
kSmall nuclear ribonucleoprotein sm D2protein8521% helix, 51% strandP62316
mSmall nuclear ribonucleoprotein Fprotein7415% helix, 57% strandP62306
lSmall nuclear ribonucleoprotein Eprotein7918% helix, 58% strandP62304
nSmall nuclear ribonucleoprotein Gprotein689% helix, 56% strandP62308
uSplicing factor 3A subunit 1protein12463% helix, 1% strandQ15459
vSplicing factor 3A subunit 2protein995% helix, 22% strandQ15428
wSplicing factor 3A subunit 3protein44360% helix, 3% strandQ12874
1Splicing factor 3B subunit 1protein103071% helix, 0% strandO75533
2Splicing factor 3B subunit 2protein18631% helix, 5% strandQ13435
3Splicing factor 3B subunit 3protein11747% helix, 43% strandQ15393
4Splicing factor 3B subunit 4protein7824% helix, 38% strandQ15427
5Splicing factor 3B subunit 6protein10826% helix, 22% strandQ9Y3B4
6Phd finger-like domain-containing protein 5Aprotein8916% helix, 20% strandQ7RTV0
7Splicing factor 3B subunit 5protein6659% helix, 0% strandQ9BWJ5
JU4/U6 small nuclear ribonucleoprotein PRP3protein16737% helix, 20% strandO43395
KU4/U6 small nuclear ribonucleoprotein PRP4protein34312% helix, 40% strandO43172
NPre-mRNA-processing factor 6protein57970% helix, 0% strandO94906
LU4/U6 small nuclear ribonucleoprotein PRP31protein22673% helix, 0% strandQ8WWY3
MNHP2-like protein 1protein12548% helix, 15% strandP55769
OThioredoxin-like protein 4Aprotein13930% helix, 19% strandP83876
WU4/U6.U5 tri-snrnp-associated protein 2protein46323% helix, 20% strandQ53GS9
IU4SNRNArna117——
PSmall nuclear ribonucleoprotein sm D2protein7415% helix, 46% strandP62316
QSmall nuclear ribonucleoprotein Fprotein7110% helix, 51% strandP62306
SSmall nuclear ribonucleoprotein Gprotein7311% helix, 45% strandP62308
TSmall nuclear ribonucleoprotein sm D3protein7110% helix, 54% strandP62318
USmall nuclear ribonucleoprotein-associated proteins B and B'protein640% helix, 55% strandP14678
VSmall nuclear ribonucleoprotein sm D1protein829% helix, 41% strandP62314
XProbable ATP-dependent RNA helicase DDX23 (EC 3.6.4.13)protein41447% helix, 14% strandQ9BUQ8
APre-mRNA-processing-splicing factor 8protein222143% helix, 11% strandQ6P2Q9
C116 kda U5 small nuclear ribonucleoprotein componentprotein81838% helix, 21% strandQ15029

Ligands and binding sites

  • IHP · Inositol hexakisphosphate · ligand · chains A
  • GTP · Guanosine-5'-triphosphate · ligand · chains A, C
  • MG · Magnesium ion · metal · chains C

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
111540.750.79135empty
29050.750.79109empty
38590.750.8098empty
47580.740.8087empty
59130.730.78115empty

Interfaces

105 interfaces between chains.

  • F–I · 1511 Ų buried · 116 hydrogen bonds · nucleic-nucleic
  • A–C · 1257 Ų buried · 18 hydrogen bonds · protein-protein
  • B–A · 1041 Ų buried · 21 hydrogen bonds · protein-nucleic
  • G–H · 774 Ų buried · 73 hydrogen bonds · nucleic-nucleic
  • F–H · 575 Ų buried · 60 hydrogen bonds · nucleic-nucleic

Compared structures

  • 6AH0 · The Cryo-EM Structure of the Precusor of Human Pre-catalytic Spliceosome (pre-B complex) · the same entry in another collection · chain b against b, TM-score 1.00

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