2.400 Å
X-ray
2011-12-30
Name: | Uncharacterized protein |
---|---|
ID: | A7TUX7_STRLI |
AC: | A7TUX7 |
Organism: | Streptomyces lividans |
Reign: | Bacteria |
TaxID: | 1916 |
EC Number: | / |
Chain Name: | Percentage of Residues within binding site |
---|---|
A | 93 % |
B | 7 % |
B-Factor: | 15.996 |
---|---|
Number of residues: | 36 |
Including | |
Standard Amino Acids: | 30 |
Non Standard Amino Acids: | 0 |
Water Molecules: | 6 |
Cofactors: | |
Metals: |
Ligandability | Volume (Å3) |
---|---|
0.175 | 320.625 |
% Hydrophobic | % Polar |
---|---|
40.00 | 60.00 |
According to VolSite |
HET Code: | PLP |
---|---|
Formula: | C8H8NO6P |
Molecular weight: | 245.126 g/mol |
DrugBank ID: | DB00114 |
Buried Surface Area: | 65.34 % |
Polar Surface area: | 132.42 Å2 |
Number of | |
---|---|
H-Bond Acceptors: | 7 |
H-Bond Donors: | 1 |
Rings: | 1 |
Aromatic rings: | 1 |
Anionic atoms: | 2 |
Cationic atoms: | 0 |
Rule of Five Violation: | 0 |
Rotatable Bonds: | 4 |
X | Y | Z |
---|---|---|
10.2194 | -8.68673 | 24.2831 |
Represent the protein/ligand binding mode, centered on the ligand
Dashed lines represents hydrogen bonds and metal interactions
Green residue labels for amino acids with hydrophobic contacts (green lines) to the ligand
Ligand | Protein | Interaction | |||
---|---|---|---|---|---|
Atom | Atom | Residue | Distance (Å) | Angle (°) | Type |
O1P | N | ALA- 69 | 3.06 | 162.14 | H-Bond (Protein Donor) |
C5A | CB | ALA- 69 | 3.94 | 0 | Hydrophobic |
O2P | N | THR- 70 | 2.88 | 158.2 | H-Bond (Protein Donor) |
O2P | OG1 | THR- 70 | 2.68 | 156.23 | H-Bond (Protein Donor) |
C2A | CB | HIS- 99 | 3.77 | 0 | Hydrophobic |
C3 | CB | HIS- 99 | 4.39 | 0 | Hydrophobic |
DuAr | DuAr | HIS- 99 | 3.6 | 0 | Aromatic Face/Face |
C2A | CE | MET- 146 | 3.97 | 0 | Hydrophobic |
C2A | CB | ASN- 150 | 4.11 | 0 | Hydrophobic |
C3 | CB | ASN- 150 | 4.48 | 0 | Hydrophobic |
N1 | OD1 | ASP- 175 | 2.55 | 177.35 | H-Bond (Ligand Donor) |
C2A | CB | ALA- 177 | 4.05 | 0 | Hydrophobic |
C3 | CB | ALA- 177 | 3.76 | 0 | Hydrophobic |
O1P | OG | SER- 197 | 2.69 | 172.68 | H-Bond (Protein Donor) |
O3P | NE2 | HIS- 199 | 2.85 | 166.14 | H-Bond (Protein Donor) |
C4A | CE | LYS- 200 | 3.48 | 0 | Hydrophobic |
O3P | OG1 | THR- 242 | 3.4 | 131.7 | H-Bond (Protein Donor) |
O1P | O | HOH- 516 | 2.92 | 179.98 | H-Bond (Protein Donor) |