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Zinc in PDB 5lsz: Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives

Enzymatic activity of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives

All present enzymatic activity of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives:
2.1.1.43;

Protein crystallography data

The structure of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives, PDB code: 5lsz was solved by D.Tisi, P.Pathuri, T.Heightman, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 48.45 / 1.62
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 59.475, 62.021, 77.626, 90.00, 90.00, 90.00
R / Rfree (%) 17.2 / 20.1

Zinc Binding Sites:

The binding sites of Zinc atom in the Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives (pdb code 5lsz). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 3 binding sites of Zinc where determined in the Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives, PDB code: 5lsz:
Jump to Zinc binding site number: 1; 2; 3;

Zinc binding site 1 out of 3 in 5lsz

Go back to Zinc Binding Sites List in 5lsz
Zinc binding site 1 out of 3 in the Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1801

b:25.9
occ:1.00
SG A:CYS1499 2.2 29.0 1.0
SG A:CYS1501 2.4 32.1 1.0
SG A:CYS1516 2.5 26.1 1.0
SG A:CYS1520 2.5 24.2 1.0
CB A:CYS1499 3.1 31.6 1.0
CB A:CYS1501 3.3 37.7 1.0
CB A:CYS1520 3.3 24.1 1.0
CB A:CYS1516 3.3 24.6 1.0
CA A:CYS1516 3.8 26.1 1.0
ZN A:ZN1802 3.9 20.6 1.0
S A:SCN1804 4.0 32.8 1.0
CA A:CYS1520 4.0 24.8 1.0
O A:HOH2055 4.0 23.2 1.0
SG A:CYS1529 4.1 18.5 1.0
N A:CYS1501 4.3 42.8 1.0
CA A:CYS1501 4.4 40.2 1.0
CA A:CYS1499 4.5 35.2 1.0
N A:CYS1516 4.7 27.9 1.0
C A:CYS1520 4.8 23.0 1.0
N A:LEU1521 4.8 23.4 1.0
SG A:CYS1533 4.8 29.9 1.0
C A:CYS1516 4.9 25.8 1.0
N A:GLU1500 4.9 43.8 1.0
C A:CYS1499 4.9 38.8 1.0

Zinc binding site 2 out of 3 in 5lsz

Go back to Zinc Binding Sites List in 5lsz
Zinc binding site 2 out of 3 in the Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1802

b:20.6
occ:1.00
SG A:CYS1539 2.2 19.5 1.0
SG A:CYS1529 2.3 18.5 1.0
SG A:CYS1516 2.4 26.1 1.0
SG A:CYS1533 2.4 29.9 1.0
CB A:CYS1529 3.1 19.4 1.0
S A:SCN1804 3.2 32.8 1.0
CB A:CYS1516 3.2 24.6 1.0
CB A:CYS1539 3.3 22.7 1.0
CB A:CYS1533 3.4 28.9 1.0
ZN A:ZN1801 3.9 25.9 1.0
CA A:CYS1539 4.3 24.5 1.0
C A:SCN1804 4.3 25.4 1.0
CB A:ASN1541 4.4 16.7 1.0
SG A:CYS1499 4.4 29.0 1.0
CA A:CYS1529 4.6 17.9 1.0
CA A:CYS1516 4.7 26.1 1.0
CA A:CYS1533 4.7 30.1 1.0
SG A:CYS1520 4.9 24.2 1.0
N A:ASN1541 4.9 18.2 1.0
CB A:ASN1535 5.0 37.2 1.0
ND2 A:ASN1535 5.0 34.0 1.0

Zinc binding site 3 out of 3 in 5lsz

Go back to Zinc Binding Sites List in 5lsz
Zinc binding site 3 out of 3 in the Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1803

b:13.7
occ:1.00
SG A:CYS1685 2.3 15.9 1.0
SG A:CYS1678 2.4 12.5 1.0
SG A:CYS1631 2.4 14.7 1.0
SG A:CYS1680 2.4 12.8 1.0
CB A:CYS1685 3.2 17.8 1.0
CB A:CYS1678 3.3 13.0 1.0
CB A:CYS1680 3.4 13.2 1.0
CB A:CYS1631 3.4 14.7 1.0
CA A:CYS1685 3.7 19.6 1.0
N A:CYS1631 3.9 12.6 1.0
N A:CYS1680 4.1 12.3 1.0
N A:ARG1686 4.1 23.3 1.0
O A:HOH2023 4.2 18.0 1.0
CA A:CYS1680 4.3 12.7 1.0
CA A:CYS1631 4.3 14.2 1.0
C A:CYS1685 4.3 22.3 1.0
OG A:SER1682 4.5 23.1 1.0
H44 A:76K1806 4.5 11.3 1.0
CA A:CYS1678 4.6 12.6 1.0
C A:CYS1678 4.6 12.8 1.0
N A:GLY1687 4.7 21.7 1.0
O A:CYS1678 4.7 13.7 1.0
CD2 A:HIS1629 4.7 13.6 1.0
NE2 A:HIS1629 4.8 13.8 1.0
N A:GLY1681 4.9 13.8 1.0
N A:CYS1685 4.9 22.2 1.0
C A:CYS1680 5.0 13.7 1.0
C A:SER1630 5.0 12.6 1.0

Reference:

D.Tisi, E.Chiarparin, E.Tamanini, P.Pathuri, J.E.Coyle, A.Hold, F.P.Holding, N.Amin, A.C.Martin, S.J.Rich, V.Berdini, J.Yon, P.Acklam, R.Burke, L.Drouin, J.E.Harmer, F.Jeganathan, R.L.Van Montfort, Y.Newbatt, M.Tortorici, M.Westlake, A.Wood, S.Hoelder, T.D.Heightman. Structure of the Epigenetic Oncogene Mmset and Inhibition By N-Alkyl Sinefungin Derivatives. Acs Chem. Biol. V. 11 3093 2016.
ISSN: ESSN 1554-8937
PubMed: 27571355
DOI: 10.1021/ACSCHEMBIO.6B00308
Page generated: Sun Oct 27 21:27:19 2024

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