AAA: KH domain-containing, RNA-binding, signal transduction-associated protein 1 BBB: KH domain-containing, RNA-binding, signal transduction-associated protein 1 CCC: KH domain-containing, RNA-binding, signal transduction-associated protein 1 ヘテロ分子
AAA: KH domain-containing, RNA-binding, signal transduction-associated protein 1 BBB: KH domain-containing, RNA-binding, signal transduction-associated protein 1 ヘテロ分子
登録者が定義した集合体
根拠: gel filtration
27.1 kDa, 2 ポリマー
分子量 (理論値)
分子数
合計 (水以外)
27,103
8
ポリマ-
26,511
2
非ポリマー
592
6
水
36
2
タイプ
名称
対称操作
数
identity operation
1_555
x,y,z
1
Buried area
2890 Å2
ΔGint
-19 kcal/mol
Surface area
14270 Å2
2
CCC: KH domain-containing, RNA-binding, signal transduction-associated protein 1 ヘテロ分子
CCC: KH domain-containing, RNA-binding, signal transduction-associated protein 1 ヘテロ分子
登録者が定義した集合体
27 kDa, 2 ポリマー
分子量 (理論値)
分子数
合計 (水以外)
26,952
8
ポリマ-
26,511
2
非ポリマー
440
6
水
36
2
タイプ
名称
対称操作
数
identity operation
1_555
x,y,z
1
crystal symmetry operation
3_553
-x,y,-z-3/2
1
Buried area
3220 Å2
ΔGint
-26 kcal/mol
Surface area
14260 Å2
単位格子
Length a, b, c (Å)
136.726, 237.593, 82.317
Angle α, β, γ (deg.)
90.000, 90.000, 90.000
Int Tables number
20
Space group name H-M
C2221
Components on special symmetry positions
ID
モデル
要素
1
1
AAA-1001-
IOD
非結晶学的対称性 (NCS)
NCSドメイン:
ID
Ens-ID
詳細
1
1
AAA
2
1
BBB
3
2
AAA
4
2
CCC
5
3
BBB
6
3
CCC
NCSドメイン領域:
Beg auth comp-ID: ASN / Beg label comp-ID: ASN / End auth comp-ID: MET / End label comp-ID: MET / Auth seq-ID: 144 - 259 / Label seq-ID: 1 - 116
解像度: 3.333→118.797 Å / Cor.coef. Fo:Fc: 0.938 / Cor.coef. Fo:Fc free: 0.931 / SU B: 25.676 / SU ML: 0.332 / 交差検証法: FREE R-VALUE / ESU R: 0.452 / ESU R Free: 0.33 / 詳細: Hydrogens have not been used
Rfactor
反射数
%反射
Rfree
0.2503
1054
5.293 %
Rwork
0.2167
18860
-
all
0.218
-
-
obs
-
19914
99.371 %
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: 117.854 Å2
Baniso -1
Baniso -2
Baniso -3
1-
-8.496 Å2
-0 Å2
-0 Å2
2-
-
15.213 Å2
-0 Å2
3-
-
-
-6.717 Å2
精密化ステップ
サイクル: LAST / 解像度: 3.333→118.797 Å
タンパク質
核酸
リガンド
溶媒
全体
原子数
2786
0
37
9
2832
拘束条件
Refine-ID
タイプ
Dev ideal
Dev ideal target
数
X-RAY DIFFRACTION
r_bond_refined_d
0.008
0.012
2874
X-RAY DIFFRACTION
r_angle_refined_deg
2.025
1.644
3838
X-RAY DIFFRACTION
r_dihedral_angle_1_deg
8.238
5
345
X-RAY DIFFRACTION
r_dihedral_angle_2_deg
39.547
23.333
135
X-RAY DIFFRACTION
r_dihedral_angle_3_deg
21.596
15
564
X-RAY DIFFRACTION
r_dihedral_angle_4_deg
28.548
15
12
X-RAY DIFFRACTION
r_chiral_restr
0.184
0.2
342
X-RAY DIFFRACTION
r_gen_planes_refined
0.008
0.02
2110
X-RAY DIFFRACTION
r_nbd_refined
0.253
0.2
1228
X-RAY DIFFRACTION
r_nbtor_refined
0.331
0.2
1866
X-RAY DIFFRACTION
r_xyhbond_nbd_refined
0.163
0.2
63
X-RAY DIFFRACTION
r_symmetry_nbd_refined
0.235
0.2
48
X-RAY DIFFRACTION
r_symmetry_xyhbond_nbd_refined
0.111
0.2
5
X-RAY DIFFRACTION
r_mcbond_it
10.892
11.196
1389
X-RAY DIFFRACTION
r_mcangle_it
16.404
16.794
1731
X-RAY DIFFRACTION
r_scbond_it
14.161
12.143
1485
X-RAY DIFFRACTION
r_scangle_it
19.503
17.864
2107
X-RAY DIFFRACTION
r_lrange_it
23.716
212.632
11173
X-RAY DIFFRACTION
r_ncsr_local_group_1
0.073
0.05
3625
X-RAY DIFFRACTION
r_ncsr_local_group_2
0.073
0.05
3589
X-RAY DIFFRACTION
r_ncsr_local_group_3
0.077
0.05
3580
Refine LS restraints NCS
Ens-ID
Dom-ID
Auth asym-ID
Refine-ID
タイプ
Rms dev position (Å)
Weight position
1
1
AAA
X-RAY DIFFRACTION
Localncs
0.07319
0.05011
1
2
BBB
X-RAY DIFFRACTION
Localncs
0.07319
0.05011
2
3
AAA
X-RAY DIFFRACTION
Localncs
0.07305
0.05011
2
4
CCC
X-RAY DIFFRACTION
Localncs
0.07305
0.05011
3
5
BBB
X-RAY DIFFRACTION
Localncs
0.07729
0.05011
3
6
CCC
X-RAY DIFFRACTION
Localncs
0.07729
0.05011
LS精密化 シェル
Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20