Atomistry » Iodine » PDB 7fgk-7lqp » 7loa
Atomistry »
  Iodine »
    PDB 7fgk-7lqp »
      7loa »

Iodine in PDB 7loa: T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene

Enzymatic activity of T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene

All present enzymatic activity of T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene:
3.2.1.17;

Protein crystallography data

The structure of T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene, PDB code: 7loa was solved by A.S.Kamenik, I.Singh, P.Lak, T.E.Balius, K.R.Liedl, B.K.Shoichet, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 52.01 / 1.07
Space group P 32 2 1
Cell size a, b, c (Å), α, β, γ (°) 60.057, 60.057, 96.276, 90, 90, 120
R / Rfree (%) 21.2 / 21.9

Other elements in 7loa:

The structure of T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene also contains other interesting chemical elements:

Fluorine (F) 1 atom

Iodine Binding Sites:

The binding sites of Iodine atom in the T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene (pdb code 7loa). This binding sites where shown within 5.0 Angstroms radius around Iodine atom.
In total only one binding site of Iodine was determined in the T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene, PDB code: 7loa:

Iodine binding site 1 out of 1 in 7loa

Go back to Iodine Binding Sites List in 7loa
Iodine binding site 1 out of 1 in the T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 1 of T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene within 5.0Å range:
probe atom residue distance (Å) B Occ
A:I201

b:79.5
occ:1.00
I07 A:Y7V201 0.0 79.5 1.0
C06 A:Y7V201 2.1 21.3 1.0
C08 A:Y7V201 3.0 21.5 1.0
C05 A:Y7V201 3.1 23.0 1.0
SD A:MET102 3.3 14.1 1.0
CG1 A:VAL111 3.8 24.1 0.3
CZ A:PHE153 3.9 13.4 1.0
CB A:MET102 4.0 11.0 1.0
CG A:MET102 4.1 12.4 1.0
CA A:ALA99 4.1 10.7 1.0
CE2 A:PHE153 4.2 13.9 1.0
CE A:MET102 4.2 14.0 1.0
C02 A:Y7V201 4.3 22.0 1.0
C04 A:Y7V201 4.4 23.2 1.0
CD2 A:LEU118 4.4 20.4 1.0
CB A:ALA99 4.5 12.0 1.0
O A:ALA99 4.5 11.3 1.0
CD1 A:LEU121 4.7 14.1 1.0
C A:ALA99 4.8 10.6 1.0
C03 A:Y7V201 4.9 6.3 1.0

Reference:

A.S.Kamenik, I.Singh, P.Lak, T.E.Balius, K.R.Liedl, B.K.Shoichet. Ligand Discovery to Find the Key to Opening: Testing Molecular Dynamics Based Energy Penalties For Flexible Receptor Docking To Be Published.
Page generated: Mon Aug 12 01:29:54 2024

Last articles

Mg in 4Y52
Mg in 4Y30
Mg in 4Y2V
Mg in 4Y2X
Mg in 4Y2Y
Mg in 4Y2U
Mg in 4Y2T
Mg in 4Y2Q
Mg in 4Y2R
Mg in 4Y2S
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy