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Restriction endonuclease bamhi complex with DNA and manganese ions (post-reactive complex)

Analyse Restriction endonuclease bamhi complex with DNA and manganese ions… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3BAM
Type
protein + DNA
Length
438 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*TP*AP*TP*GP*GP*AP*TP*CP*CP*AP*TP*A)- 3'); DNA (5'-D(*TP*AP*TP*G)-3'); DNA…
EC
3.1.21.4
UniProt
P23940
Ligands
MN
Pockets
5 · best druggability 0.71

Structure

x-ray diffraction · 5 distinct chains · 37% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CDNA (5'-D(*TP*AP*TP*GP*GP*AP*TP*CP*CP*AP*TP*A)- 3')dna12——
DDNA (5'-D(*TP*AP*TP*G)-3')dna4——
EDNA (5'-D(P*GP*AP*TP*CP*CP*AP*TP*A)-3')dna7——
AProtein (restriction endonuclease bamhi) (EC 3.1.21.4)protein20636% helix, 27% strandP23940
BProtein (restriction endonuclease bamhi) (EC 3.1.21.4)protein20938% helix, 26% strandP23940

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains D, E, A

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

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14240.710.8238empty
21030.630.8917empty
32880.540.7626MN
41220.420.7720empty
5870.390.7716empty

Interfaces

10 interfaces between chains.

  • A–B · 1196 Ų buried · 17 hydrogen bonds · protein-protein
  • E–A · 723 Ų buried · 19 hydrogen bonds · protein-nucleic
  • C–B · 670 Ų buried · 20 hydrogen bonds · protein-nucleic
  • C–A · 624 Ų buried · 12 hydrogen bonds · protein-nucleic
  • C–E · 321 Ų buried · 25 hydrogen bonds · nucleic-nucleic

Compared structures

  • 3BAM · Restriction endonuclease bamhi complex with DNA and manganese ions (post-reactive complex) · the same entry in another collection · chain D against D, TM-score 1.00
  • P23940 · AlphaFold monomer V2.0 prediction for type-2 restriction enzyme bamhi (P23940) · a predicted model of the same protein · chain B against A, TM-score 0.94

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