Atomistry » Bromine » PDB 4alu-4d45 » 4anm
Atomistry »
  Bromine »
    PDB 4alu-4d45 »
      4anm »

Bromine in PDB 4anm: Complex of CK2 with A CDC7 Inhibitor

Enzymatic activity of Complex of CK2 with A CDC7 Inhibitor

All present enzymatic activity of Complex of CK2 with A CDC7 Inhibitor:
2.7.11.1;

Protein crystallography data

The structure of Complex of CK2 with A CDC7 Inhibitor, PDB code: 4anm was solved by T.J.Stout, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 36.71 / 1.70
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 142.061, 60.549, 44.747, 90.00, 102.92, 90.00
R / Rfree (%) 16.444 / 20.184

Bromine Binding Sites:

The binding sites of Bromine atom in the Complex of CK2 with A CDC7 Inhibitor (pdb code 4anm). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total only one binding site of Bromine was determined in the Complex of CK2 with A CDC7 Inhibitor, PDB code: 4anm:

Bromine binding site 1 out of 1 in 4anm

Go back to Bromine Binding Sites List in 4anm
Bromine binding site 1 out of 1 in the Complex of CK2 with A CDC7 Inhibitor


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Complex of CK2 with A CDC7 Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1334

b:18.9
occ:1.00
BR1 A:WUL1334 0.0 18.9 1.0
C10 A:WUL1334 2.0 10.3 1.0
C9 A:WUL1334 2.8 11.2 1.0
C11 A:WUL1334 2.9 10.1 1.0
O A:VAL116 3.2 16.4 1.0
O A:HOH2171 3.7 32.2 1.0
CD1 A:ILE66 3.8 33.5 1.0
CG1 A:ILE66 3.9 12.1 1.0
SD A:MET163 3.9 13.3 1.0
N A:VAL116 4.0 15.3 1.0
CB A:VAL116 4.0 15.7 1.0
C8 A:WUL1334 4.1 13.5 1.0
C A:VAL116 4.1 16.0 1.0
CG A:MET163 4.2 12.2 1.0
O A:HOH2076 4.2 37.8 1.0
C7 A:WUL1334 4.2 10.9 1.0
CA A:VAL116 4.3 13.8 1.0
CB A:ASN118 4.6 16.4 1.0
C6 A:WUL1334 4.6 13.0 1.0
CG2 A:VAL116 4.8 14.1 1.0
CB A:MET163 4.8 11.2 1.0
O A:HOH2178 4.9 26.8 1.0
CB A:ILE66 4.9 11.5 1.0
CG2 A:ILE66 4.9 10.4 1.0

Reference:

E.S.Koltun, A.L.Tsuhako, D.S.Brown, N.Aay, A.Arcalas, V.Chan, H.Du, S.Engst, K.Ferguson, M.Franzini, A.Galan, C.R.Holst, P.Huang, B.Kane, M.H.Kim, J.Li, D.Markby, M.Mohan, K.Noson, A.Plonowski, S.J.Richards, S.Robertson, K.Shaw, G.Stott, T.J.Stout, J.Young, P.Yu, C.A.Zaharia, W.Zhang, P.Zhou, J.M.Nuss, W.Xu, P.C.Kearney. Discovery of XL413, A Potent and Selective CDC7 Inhibitor. Bioorg.Med.Chem.Lett. V. 22 3727 2012.
ISSN: ISSN 0960-894X
PubMed: 22560567
DOI: 10.1016/J.BMCL.2012.04.024
Page generated: Sat Dec 12 02:18:10 2020

Last articles

Tb in 6TVY
Si in 6Y7O
Rh in 6WRM
Rh in 6WRL
Ni in 6Y8Z
Ni in 6Y8Y
Na in 6ZXZ
Na in 7ACG
Na in 6YLS
Na in 6Y8Z
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy