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PDBsum entry 8cxy

Go to PDB code: 
protein dna_rna ligands metals Protein-protein interface(s) links
DNA binding protein/DNA PDB id
8cxy

 

 

 

 

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JSmol PyMol  
Contents
Protein chains
545 a.a.
DNA/RNA
Ligands
EDO ×16
Q8R ×3
Metals
__K ×7
Waters ×716
PDB id:
8cxy
Name: DNA binding protein/DNA
Title: Cama adenine methyltransferase complexed to cognate substrate DNA and inhibitor n6-(2-phenethyl)adenosine (compound 8)
Structure: Site-specific DNA-methyltransferase (adenine-specific). Chain: a, b, c. Engineered: yes. DNA strand 1. Chain: d, f, h. Engineered: yes. DNA strand 2. Chain: e, g, i. Engineered: yes
Source: Clostridioides difficile. Organism_taxid: 1496. Gene: bn1095_20232, bn1096_690041, bn1097_700039, e5f26_07025, e5f27_14470, e5f28_16275, e5f29_09620, e5f30_09400, e5f31_14185, e5f32_03810, e5f33_08870, e5f36_00990, e5f37_03060, e5f38_04245, e5f39_00835, e5f40_02785, e5f41_17405, e5f42_11180, e5f43_12285, e5f44_14865, e5f45_19095. Expressed in: escherichia coli bl21(de3). Expression_system_taxid: 469008.
Resolution:
2.19Å     R-factor:   0.175     R-free:   0.206
Authors: J.R.Horton,J.Zhou,X.Cheng
Key ref: J.Zhou et al. Systematic design of adenosine analogs as inhibitors clostridioides difficile- Specific DNA adenine methyltransferase required for normal sporulation and persistence.. J med chem, . PubMed id: 36581322
Date:
22-May-22     Release date:   11-Jan-23    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chains
Pfam   ArchSchema ?
Q183J3  (Q183J3_PEPD6) -  site-specific DNA-methyltransferase (adenine-specific) from Clostridioides difficile (strain 630)
Seq:
Struc:
 
Seq:
Struc:
577 a.a.
545 a.a.
Key:    PfamA domain  Secondary structure

DNA/RNA chains
  T-T-C-A-A-A-A-A-G-T-C-C-C-A 14 bases
  A-T-G-G-G-A-C-T-T-T-T-T-G-A 14 bases
  T-T-C-A-A-A-A-A-G-T-C-C-C-A 14 bases
  A-T-G-G-G-A-C-T-T-T-T-T-G-A 14 bases
  T-T-C-A-A-A-A-A-G-T-C-C-C-A 14 bases
  A-T-G-G-G-A-C-T-T-T-T-T-G-A 14 bases

 Enzyme reactions 
   Enzyme class: E.C.2.1.1.72  - site-specific DNA-methyltransferase (adenine-specific).
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: a 2'-deoxyadenosine in DNA + S-adenosyl-L-methionine = an N6-methyl- 2'-deoxyadenosine in DNA + S-adenosyl-L-homocysteine + H+
2'-deoxyadenosine in DNA
+ S-adenosyl-L-methionine
= N(6)-methyl- 2'-deoxyadenosine in DNA
+ S-adenosyl-L-homocysteine
+ H(+)
Bound ligand (Het Group name = Q8R)
matches with 51.43% similarity
Molecule diagrams generated from .mol files obtained from the KEGG ftp site

 

 

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