- PDB-7wgk: Crystal structure of Adenosine triphosphate phosphoribosyltransfe... -
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基本情報
登録情報
データベース: PDB / ID: 7wgk
タイトル
Crystal structure of Adenosine triphosphate phosphoribosyltransferase (HisG) from Acinetobacter baumannii at 3.13 A resolution
要素
ATP phosphoribosyltransferase
キーワード
TRANSFERASE (転移酵素) / Catalytic Domain of ATP-PRT / HisG
機能・相同性
機能・相同性情報
ATP phosphoribosyltransferase / ATP phosphoribosyltransferase activity / L-histidine biosynthetic process / ATP binding / 細胞質 類似検索 - 分子機能
ATP phosphoribosyltransferase HisG, short form / ATP phosphoribosyltransferase HisG / ATP phosphoribosyltransferase, catalytic domain / ATP phosphoribosyltransferase, conserved site / ATP phosphoribosyltransferase / ATP phosphoribosyltransferase signature. 類似検索 - ドメイン・相同性
解像度: 3.13→59.488 Å / Cor.coef. Fo:Fc: 0.922 / Cor.coef. Fo:Fc free: 0.847 / SU B: 26.73 / SU ML: 0.436 / 交差検証法: FREE R-VALUE / ESU R Free: 0.553 / 詳細: Hydrogens have been added in their riding positions
Rfactor
反射数
%反射
Rfree
0.2987
502
4.576 %
Rwork
0.2186
10469
-
all
0.222
-
-
obs
-
10971
99.528 %
溶媒の処理
イオンプローブ半径: 0.8 Å / 減衰半径: 0.8 Å / VDWプローブ半径: 1.2 Å / 溶媒モデル: MASK BULK SOLVENT
原子変位パラメータ
Biso mean: 70.246 Å2
Baniso -1
Baniso -2
Baniso -3
1-
-0.037 Å2
0 Å2
0 Å2
2-
-
1.06 Å2
-0 Å2
3-
-
-
-1.023 Å2
精密化ステップ
サイクル: LAST / 解像度: 3.13→59.488 Å
タンパク質
核酸
リガンド
溶媒
全体
原子数
3518
0
0
24
3542
拘束条件
Refine-ID
タイプ
Dev ideal
Dev ideal target
数
X-RAY DIFFRACTION
r_bond_refined_d
0.006
0.013
3564
X-RAY DIFFRACTION
r_bond_other_d
0.001
0.017
3612
X-RAY DIFFRACTION
r_angle_refined_deg
1.573
1.638
4814
X-RAY DIFFRACTION
r_angle_other_deg
1.186
1.584
8308
X-RAY DIFFRACTION
r_dihedral_angle_1_deg
7.91
5
452
X-RAY DIFFRACTION
r_dihedral_angle_2_deg
39.693
22.674
172
X-RAY DIFFRACTION
r_dihedral_angle_3_deg
19.874
15
678
X-RAY DIFFRACTION
r_dihedral_angle_4_deg
16.808
15
24
X-RAY DIFFRACTION
r_chiral_restr
0.065
0.2
468
X-RAY DIFFRACTION
r_gen_planes_refined
0.005
0.02
3978
X-RAY DIFFRACTION
r_gen_planes_other
0.002
0.02
750
X-RAY DIFFRACTION
r_nbd_refined
0.222
0.2
571
X-RAY DIFFRACTION
r_symmetry_nbd_other
0.205
0.2
3196
X-RAY DIFFRACTION
r_nbtor_refined
0.155
0.2
1628
X-RAY DIFFRACTION
r_symmetry_nbtor_other
0.08
0.2
1854
X-RAY DIFFRACTION
r_xyhbond_nbd_refined
0.17
0.2
45
X-RAY DIFFRACTION
r_symmetry_xyhbond_nbd_other
0.048
0.2
1
X-RAY DIFFRACTION
r_symmetry_nbd_refined
0.35
0.2
3
X-RAY DIFFRACTION
r_nbd_other
0.182
0.2
34
X-RAY DIFFRACTION
r_symmetry_xyhbond_nbd_refined
0.33
0.2
3
X-RAY DIFFRACTION
r_mcbond_it
5
7.148
1814
X-RAY DIFFRACTION
r_mcbond_other
4.97
7.146
1813
X-RAY DIFFRACTION
r_mcangle_it
8.122
10.707
2264
X-RAY DIFFRACTION
r_mcangle_other
8.123
10.712
2265
X-RAY DIFFRACTION
r_scbond_it
5.22
7.828
1750
X-RAY DIFFRACTION
r_scbond_other
5.218
7.83
1751
X-RAY DIFFRACTION
r_scangle_it
8.708
11.45
2550
X-RAY DIFFRACTION
r_scangle_other
8.706
11.453
2551
X-RAY DIFFRACTION
r_lrange_it
15.414
133.321
13251
X-RAY DIFFRACTION
r_lrange_other
15.413
133.318
13252
LS精密化 シェル
Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20