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MolNFT v1 · #146705 · protein + DNA + RNA

Crystal structure of bacillus halodurans ribonuclease H1 K196A in complex with an RNA/DNA hybrid: reaction in 10 mm MG2+ and 200 mm rb+ for 40 S at 21 C

6DPI: “Crystal structure of bacillus halodurans ribonuclease H1 K196A in complex with an RNA/DNA hybrid: reaction in…”. X-ray diffraction, 3 ligands (RB, MG, CL). MolNFT v1 #146705 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6DPI
Type
protein + DNA + RNA
Length
148 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonuclease H; 5'-R(*AP*CP*AP*U)-3' portion of intact RNA (5'- R(*AP*CP*AP*UP*CP*G)-3')…
EC
3.1.26.4
UniProt
Q9KEI9
Ligands
RB, MG, CL

Structure

x-ray diffraction · 4 distinct chains · 35% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibonuclease H (EC 3.1.26.4)protein13635% helix, 26% strandQ9KEI9
B5'-R(*AP*CP*AP*U)-3' portion of intact RNA (5'- R(*AP*CP*AP*UP*CP*G)-3')rna4——
b5'-R(P*CP*G)-3' portion of intact RNA (5'- R(*AP*CP*AP*UP*CP*G)-3')rna2——
CDNA (5'-D(*CP*GP*AP*TP*GP*T)-3')dna6——

Ligands and binding sites

  • RB · Rubidium ion · metal · 3 copies · chains A, b, B, C
  • MG · Magnesium ion · metal · 2 copies · chains A, b, B
  • CL · Chloride ion · ion · 3 copies · chains A
  • GOL · Glycerol · additive · 4 copies · chains A, b, C
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A, C

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

Interfaces

6 interfaces between chains.

  • A–C · 437 Ų buried · 14 hydrogen bonds · protein-nucleic
  • A–b · 319 Ų buried · 13 hydrogen bonds · protein-nucleic
  • A–B · 278 Ų buried · 14 hydrogen bonds · protein-nucleic
  • B–C · 188 Ų buried · 14 hydrogen bonds · nucleic-nucleic
  • b–C · 145 Ų buried · 9 hydrogen bonds · nucleic-nucleic

Compared structures

  • 6DPI · Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with an RNA/DNA… · the same entry in another collection · chain A against A, TM-score 1.00

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