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Strontium in PDB 6ttn: N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine

Protein crystallography data

The structure of N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine, PDB code: 6ttn was solved by A.Kluza, B.Mrugala, P.J.Porebski, K.Kurpiewska, E.Niedzialkowska, M.S.Weiss, T.Borowski, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.78 / 1.12
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 39.894, 79.841, 104.701, 90.00, 90.00, 90.00
R / Rfree (%) 12.7 / 14.6

Other elements in 6ttn:

The structure of N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine also contains other interesting chemical elements:

Nickel (Ni) 1 atom
Sodium (Na) 1 atom

Strontium Binding Sites:

The binding sites of Strontium atom in the N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine (pdb code 6ttn). This binding sites where shown within 5.0 Angstroms radius around Strontium atom.
In total only one binding site of Strontium was determined in the N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine, PDB code: 6ttn:

Strontium binding site 1 out of 1 in 6ttn

Go back to Strontium Binding Sites List in 6ttn
Strontium binding site 1 out of 1 in the N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine


Mono view


Stereo pair view

A full contact list of Strontium with other atoms in the Sr binding site number 1 of N-Terminally Truncated Hyoscyamine 6-Hydroxylase (TH6H) in Complex with N-Oxalylglycine and Hyoscyamine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Sr507

b:10.8
occ:0.89
O A:HOH708 2.6 15.5 1.0
O A:GLY67 2.6 10.4 1.0
O A:HOH702 2.6 16.6 1.0
C A:GLY67 3.7 9.3 1.0
HA2 A:GLY67 3.8 11.6 1.0
HD3 A:PRO69 3.9 12.8 1.0
HG3 A:PRO69 4.1 14.0 1.0
HA3 A:GLY67 4.1 11.6 1.0
CA A:GLY67 4.1 9.7 1.0
O A:HOH629 4.5 26.0 1.0
OE1 A:GLU164 4.6 14.9 1.0
HA A:VAL68 4.7 11.3 1.0
CD A:PRO69 4.7 10.7 1.0
O A:HOH612 4.7 38.7 1.0
HZ1 A:LYS167 4.7 30.1 0.6
OE2 A:GLU164 4.7 18.2 1.0
N A:VAL68 4.8 9.3 1.0
CG A:PRO69 4.8 11.7 1.0
O A:HOH991 4.9 28.1 1.0

Reference:

A.Kluza, Z.Wojdyla, B.Mrugala, K.Kurpiewska, P.J.Porebski, E.Niedzialkowska, W.Minor, M.S.Weiss, T.Borowski. Regioselectivity of Hyoscyamine 6 Beta-Hydroxylase-Catalysed Hydroxylation As Revealed By High-Resolution Structural Information and Qm/Mm Calculations Dalton Trans 2020.
ISSN: ESSN 1477-9234
DOI: 10.1039/D0DT00302F
Page generated: Wed Dec 16 02:25:15 2020

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