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- PDB-6wef: Copper-bound D92H variant of Campylobacter jejuni P19 -

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IDまたはキーワード:

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基本情報

登録情報
データベース: PDB / ID: 6wef
タイトルCopper-bound D92H variant of Campylobacter jejuni P19
要素Uncharacterized protein
キーワードTRANSPORT PROTEIN / iron transport / copper cofactor / periplasmic
機能・相同性Periplasmic metal-binding protein Tp34-type / Periplasmic metal-binding protein Tp34-type superfamily / Fe2+ transport protein / metal ion binding / COPPER (II) ION / Iron transporter
機能・相同性情報
生物種Campylobacter jejuni subsp. jejuni serotype O:23/36 (カンピロバクター)
手法X線回折 / 分子置換 / 解像度: 2.501 Å
データ登録者Chan, A.C. / Murphy, M.E.
資金援助 カナダ, 1件
組織認可番号
Natural Sciences and Engineering Research Council (NSERC, Canada) カナダ
引用ジャーナル: Metallomics / : 2020
タイトル: A copper site is required for iron transport by the periplasmic proteins P19 and FetP.
著者: Chan, A.C.K. / Lin, H. / Koch, D. / Grass, G. / Nies, D.H. / Murphy, M.E.P.
履歴
登録2020年4月2日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02021年2月10日Provider: repository / タイプ: Initial release
改定 1.12023年10月18日Group: Data collection / Database references / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession

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構造の表示

構造ビューア分子:
MolmilJmol/JSmol

ダウンロードとリンク

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集合体

登録構造単位
C: Uncharacterized protein
D: Uncharacterized protein
A: Uncharacterized protein
B: Uncharacterized protein
E: Uncharacterized protein
F: Uncharacterized protein
G: Uncharacterized protein
H: Uncharacterized protein
I: Uncharacterized protein
J: Uncharacterized protein
K: Uncharacterized protein
L: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)213,55539
ポリマ-211,36712
非ポリマー2,18827
9,746541
1
C: Uncharacterized protein
D: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,5476
ポリマ-35,2282
非ポリマー3194
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area4140 Å2
ΔGint-97 kcal/mol
Surface area14500 Å2
手法PISA
2
A: Uncharacterized protein
B: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,6437
ポリマ-35,2282
非ポリマー4155
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area4500 Å2
ΔGint-97 kcal/mol
Surface area14730 Å2
手法PISA
3
E: Uncharacterized protein
F: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,6437
ポリマ-35,2282
非ポリマー4155
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area3930 Å2
ΔGint-83 kcal/mol
Surface area14630 Å2
手法PISA
4
G: Uncharacterized protein
H: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,7278
ポリマ-35,2282
非ポリマー4996
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area4000 Å2
ΔGint-67 kcal/mol
Surface area14490 Å2
手法PISA
5
I: Uncharacterized protein
J: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,5476
ポリマ-35,2282
非ポリマー3194
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area3930 Å2
ΔGint-84 kcal/mol
Surface area14070 Å2
手法PISA
6
K: Uncharacterized protein
L: Uncharacterized protein
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)35,4475
ポリマ-35,2282
非ポリマー2193
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area3820 Å2
ΔGint-52 kcal/mol
Surface area14410 Å2
手法PISA
単位格子
Length a, b, c (Å)132.455, 132.455, 104.585
Angle α, β, γ (deg.)90.000, 90.000, 120.000
Int Tables number145
Space group name H-MP32

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要素

#1: タンパク質
Uncharacterized protein


分子量: 17613.920 Da / 分子数: 12 / 変異: D92H / 由来タイプ: 組換発現
由来: (組換発現) Campylobacter jejuni subsp. jejuni serotype O:23/36 (strain 81-176) (カンピロバクター)
: 81-176 / 遺伝子: CJJ81176_1650 / プラスミド: pET28a / 発現宿主: Escherichia coli BL21(DE3) (大腸菌) / 株 (発現宿主): BL21(DE3) / 参照: UniProt: A0A0H3PA01
#2: 化合物
ChemComp-CU / COPPER (II) ION


分子量: 63.546 Da / 分子数: 12 / 由来タイプ: 合成 / : Cu / タイプ: SUBJECT OF INVESTIGATION
#3: 化合物
ChemComp-SO4 / SULFATE ION / 硫酸ジアニオン


分子量: 96.063 Da / 分子数: 11 / 由来タイプ: 合成 / : SO4
#4: 化合物
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL / グリセロ-ル


分子量: 92.094 Da / 分子数: 4 / 由来タイプ: 合成 / : C3H8O3
#5: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 541 / 由来タイプ: 天然 / : H2O
研究の焦点であるリガンドがあるかY

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実験情報

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実験

実験手法: X線回折 / 使用した結晶の数: 1

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試料調製

結晶マシュー密度: 2.51 Å3/Da / 溶媒含有率: 50.92 % / Mosaicity: 0.83 ° / Mosaicity esd: 0.008 °
結晶化温度: 298 K / 手法: 蒸気拡散法, ハンギングドロップ法 / pH: 7
詳細: 2.4 M ammonium sulfate, 0.2 M lithium sulfate and 0.1 M Tris pH 7

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データ収集

回折平均測定温度: 100 K / Serial crystal experiment: N
放射光源由来: 回転陽極 / タイプ: RIGAKU MICROMAX-007 HF / 波長: 1.5418 Å
検出器タイプ: RIGAKU SATURN 944+ / 検出器: CCD / 日付: 2018年9月21日
放射プロトコル: SINGLE WAVELENGTH / 単色(M)・ラウエ(L): M / 散乱光タイプ: x-ray
放射波長波長: 1.5418 Å / 相対比: 1
Reflection twinOperator: -h,-k,l / Fraction: 0.49
反射解像度: 2.5→50 Å / Num. obs: 70171 / % possible obs: 99 % / 冗長度: 4.9 % / Rmerge(I) obs: 0.109 / Rpim(I) all: 0.054 / Rrim(I) all: 0.121 / Χ2: 0.846 / Net I/σ(I): 4.6 / Num. measured all: 341533
反射 シェル

Diffraction-ID: 1

解像度 (Å)冗長度 (%)Rmerge(I) obsNum. unique obsCC1/2Rpim(I) allRrim(I) allΧ2% possible all
2.5-2.543.50.62434060.90.3810.7350.80597.3
2.54-2.593.70.62734470.9070.3720.7320.81398.5
2.59-2.643.90.43235890.9520.2470.4990.81498.5
2.64-2.694.20.45634320.9510.250.5220.84798.1
2.69-2.754.40.4634940.950.2440.5210.8198.3
2.75-2.824.70.35635400.9620.1820.4010.82298.9
2.82-2.894.80.31234680.9730.1570.3490.80398.9
2.89-2.964.90.28835260.9740.1430.3210.81199
2.96-3.054.90.26534960.9830.130.2960.80199.1
3.05-3.1550.22435070.9820.1090.2490.82199.1
3.15-3.265.10.13735150.9950.0660.1530.81398.9
3.26-3.395.20.13835390.9930.0660.1530.83599.3
3.39-3.555.30.10334970.9960.0490.1140.86799.5
3.55-3.735.30.10235370.9960.0480.1121.04999.4
3.73-3.975.30.08434960.9980.040.0930.87999.7
3.97-4.275.30.06435730.9980.030.070.90899.4
4.27-4.75.40.05435130.9990.0250.06199.7
4.7-5.385.40.04935250.9990.0230.0550.81799.7
5.38-6.785.60.05335560.9990.0240.0580.74699.9
6.78-505.60.029351510.0130.0320.80498.9

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位相決定

位相決定手法: 分子置換
Phasing MR
最高解像度最低解像度
Rotation3.38 Å28.68 Å
Translation3.38 Å28.68 Å

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解析

ソフトウェア
名称バージョン分類
PHENIX1.14_3260精密化
DENZOデータ削減
HKL-2000データスケーリング
PHASER2.8.1位相決定
PDB_EXTRACT3.25データ抽出
精密化構造決定の手法: 分子置換
開始モデル: 3LZL
解像度: 2.501→28.677 Å / 交差検証法: THROUGHOUT / σ(F): 74.24 / 位相誤差: 35.6
Rfactor反射数%反射
Rfree0.2991 2034 2.91 %
Rwork0.2702 --
obs0.2716 69955 98.66 %
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å
原子変位パラメータBiso max: 132.34 Å2 / Biso mean: 51.1021 Å2 / Biso min: 0.15 Å2
精密化ステップサイクル: final / 解像度: 2.501→28.677 Å
タンパク質核酸リガンド溶媒全体
原子数14829 0 103 541 15473
Biso mean--55.54 22.17 -
残基数----1901
LS精密化 シェル

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 14

解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.5027-2.56530.47451420.37284598474092
2.5653-2.63450.31571350.36254831496695
2.6345-2.7120.43281460.33684783492996
2.712-2.79940.38471390.33884846498596
2.7994-2.89920.36041380.31534828496696
2.8992-3.01510.34631520.3074878503096
3.0151-3.1520.32731400.29994823496396
3.152-3.31780.37551460.25924892503896
3.3178-3.52510.29481540.2654826498096
3.5251-3.79620.29851440.24764918506297
3.7962-4.17640.29871420.21494842498497
4.1764-4.77650.19951570.19774899505697
4.7765-6.00180.23121540.24944901505597
6.0018-23.79190.31521390.30834903504297
精密化 TLS

手法: refined / Refine-ID: X-RAY DIFFRACTION

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
10.0019-0.00810.00040.0543-0.00860.0014-0.04570.03030.01240.01180.0523-0.0444-0.020.01930.0020.2250.04180.11150.57870.08630.321857.28-11.879820.953
20.01310.00610.03260.0020.00770.0765-0.1365-0.02820.04430.0651-0.01580.0330.00020.1181-0.09820.38230.22230.00820.52630.05010.269345.8458-17.119931.2817
30.05720.0020.03040.09760.00530.0244-0.0113-0.1064-0.0377-0.07810.0282-0.0985-0.0210.08990.01970.39560.14390.00570.5120.0670.22449.8528-16.09218.4594
40.0037-0.00830.00250.0175-0.00830.01260.04330.0611-0.03490.01850.0244-0.02530.06730.08070.02560.35710.19270.0060.6580.1280.402653.0242-22.282127.6046
50.008-0.0034-0.00610-0.00170.00420.13940.0551-0.045-0.01110.1225-0.05970.0678-0.032-00.29040.08790.00590.43310.08610.314941.2313-11.54613.7422
60.0097-0.0044-0.00780.0020.00280.00450.0994-0.0181-0.0238-0.0769-0.0928-0.0433-0.01740.038700.36720.19640.0110.9830.01780.487259.4376-19.333725.9849
7-0.00150.00340.00380.00340.00570.00530.0241-0.05840.06630.0055-0.01160.071-0.0267-0.038100.3048-0.0239-0.02860.344-0.05310.429428.37747.082613.8745
80.13270.09140.02220.0798-0.02470.01260.0479-0.03350.0189-0.1041-0.05450.1479-0.05410.02050.06390.19980.0636-0.05590.34010.04290.396628.3925-3.114411.2285
90.0024-0.0033-0.00240.01640.01880.0221-0.04990.0187-0.02380.02120.02090.0662-0.02630.0027-0.00960.20620.1033-0.01990.31680.0680.276535.4428-5.177.5218
100.10230.0613-0.0290.03980.00720.08930.04610.0679-0.0688-0.04730.04060.1001-0.1525-0.09230.04420.20270.0917-0.08960.28330.00450.400219.97-2.90857.0299
110.01560.0113-0.00760.0095-0.00470.00430.018-0.00540.00690.01680.0086-0.0140.0178-0.0210.01150.36820.0465-0.17730.57210.12140.497734.986-11.790626.7647
120.1016-0.0096-0.01760.00680.02120.09750.0421-0.12510.0963-0.1051-0.05250.11-0.06510.012-0.01480.27510.2177-0.04130.3094-0.06470.413728.3574-0.60720.5589
130.0673-0.0155-0.03490.0597-0.00650.03690.01460.0533-0.03340.0280.0340.04790.0293-0.00530.02180.37410.17850.02840.3066-0.05140.370428.2623-6.960154.8405
140.0169-0.011-0.0060.01440.00920.00870.05750.0314-0.01890.0867-0.06780.01750.02820.00710.01040.2302-0.09610.02410.29420.1350.490229.2987-3.037259.1749
150.00250.00030.00210.0023-0.00090.0007-0.0204-0.0115-0.0077-0.0007-0.00820.021-0.04890.0294-00.5103-0.10860.06190.4405-0.02840.47130.231111.988768.8201
160.0024-0.00420.0010.0006-0.00090.0035-0.05220.0047-0.00140.02150.03320.0737-0.0184-0.0248-00.255-0.01090.04360.34620.00740.351228.27522.588563.3629
170.05460.02250.04010.0533-0.00790.16490.0538-0.0242-0.06930.04280.03260.17620.04260.14550.04380.181-0.04790.02790.4213-0.01110.349529.67341.070951.1384
180.0050.0043-0.00690.0031-0.00730.0189-0.0316-0.02840.02380.00540.02810.0382-0.02010.0664-0.01460.2701-0.13050.04920.30720.02020.354824.50287.369659.4642
190.0103-0.0007-0.00330.00740.00420.0108-0.0093-0.00420.03810.0298-0.01130.12040.0114-0.0224-0.01980.2217-0.04020.03130.26690.06590.378533.2043.56862.2034
200.0242-0.0123-0.01490.00710.00870.01520.0011-0.01050.0134-0.00050.0239-0.00870.0091-0.01520.02070.2465-0.10550.17060.3663-0.02540.539213.61744.592669.4945
210.0120.0086-0.01030.02180.02660.09020.02820.00050.02080.096-0.048-0.02410.0816-0.02820.02650.2299-0.2020.08840.1408-0.00640.372519.0531-0.424555.5331
220.07350.0053-0.00190.0125-0.00540.05130.03750-0.0172-0.02150.079-0.0034-0.04210.0030.02990.3377-0.06420.12820.54920.13550.372935.154711.781442.4758
230.0007-0.0006-0.00070.00540.0020.0067-0.00750.02520.0069-0.0440.05830.0954-0.02870.0389-0.00220.2055-0.0734-0.01660.5911-0.04330.37937.26246.399435.6507
240.01110.0068-0.00290.0156-0.00350.0013-0.00250.0214-0.01780.0474-0.02820.0080.0446-0.0042-0.04710.3105-0.17020.03860.29870.03670.496221.1247-4.271360.7872
250.01980.0085-0.01830.0128-0.00060.02430.0008-0.00350.00480.013-0.0086-0.02830.01070.0096-0.00690.3210.0195-0.16220.72630.15340.351158.621911.411848.7441
260.0086-0.00330.00510.0091-0.0030.0058-0.0398-0.0181-0.0115-0.0245-0.0119-0.01530.00960.0581-0.00130.4136-0.2411-0.04780.62730.14410.371146.732915.940839.6648
270.02860.0013-0.01270.0298-0.00730.0548-0.03330.00110.02790.0182-0.006-0.00830.02330.05890.01910.2261-0.22850.11280.46570.17890.221450.10416.12540.9406
280.0344-0.0324-0.01280.01970.00420.0001-0.0395-0.00740.034-0.01950.0364-0.0701-0.02230.147200.4274-0.1517-0.04450.56510.08010.305150.965216.520452.0188
290.05820.02080.09190.03250.03150.1479-0.0213-0.0193-0.051-0.0006-0.0512-0.0083-0.04140.0611-0.04040.1973-0.13060.04890.59360.04720.292745.576512.763142.8047
300.0199-0.01470.01680.0042-0.01350.0140.0335-0.00030.0664-0.0199-0.0042-0.0203-0.02580.0736-0.00840.27-0.12940.0320.61680.09380.401350.316722.791548.1387
310.0050.00160.00540.0034-0.00370.00540.0229-0.0923-0.0089-0.06520.07480.0301-0.0455-0.032300.3583-0.1409-0.04880.48920.12310.314842.71919.851568.7858
320.00090.00220.0030.00290.00460.01370.0369-0.01040.00220.0254-0.0224-0.0745-0.00980.02670.0030.42-0.3213-0.00620.95830.06470.464959.781419.766843.3633
330.002-00.00280.00050.00390.0136-0.03810.01410.0567-0.00710.00560.0101-0.0255-0.0143-0.02790.31350.229-0.21330.36410.0980.282947.676417.921789.666
340.0065-0.00420.00070.00050.0001-0.0001-0.028-0.0649-0.0670.0209-0.0755-0.07970.08320.0614-00.31530.0527-0.04630.2943-0.03310.430257.48459.871899.4449
350.19890.0191-0.18750.0085-0.02960.186-0.05950.17090.08770.0917-0.0325-0.0068-0.0608-0.1738-0.00440.25780.046-0.06470.2178-0.00650.215251.71538.116388.3285
360.01120.00360.00310.00150.00540.0194-0.0235-0.01660.0713-0.0040.0137-0.00830.0396-0.01960.00220.6204-0.0031-0.15780.1811-0.01170.352762.007724.488893.3139
370.0207-0.0236-0.02710.03060.03990.0819-0.07520.02440.0350.0102-0.1007-0.01-0.0278-0.0667-0.02550.38930.06820.0070.18190.01120.369457.988310.448195.3923
380.0170.0193-0.02120.0219-0.02520.02810.0048-0.04270.0066-0.0173-0.0338-0.0046-0.0092-0.0064-0.01740.7522-0.0079-0.12720.47-0.1830.458365.478724.2708104.322
390.02620.0031-0.01210.00350.0050.05540.00030.01070.01090.05650.0556-0.0021-0.0653-0.03370.01840.56660.1629-0.10270.1413-0.06890.421858.204322.39690.2931
400.0010.00210.00050.00330.00160-0.04490.01630.033-0.006-0.0077-0.0655-0.07240.020900.3672-0.0027-0.0490.249-0.08070.280959.90982.315277.3127
410.0252-0.01210.02080.006-0.00640.01510.065-0.02760.0861-0.0237-0.039-0.0409-0.00470.0424-0.00050.3611-0.0991-0.05960.2313-0.00810.295454.50573.287570.3068
420.00070.004-0.0001-0.00060.00390.007-0.0534-0.0380.04990.01280.03730.0024-0.0532-0.0244-0.00970.64810.1817-0.03520.2490.03540.49353.794222.859495.7146
430.00220.00560.00130.01010.01220.009-0.065-0.0054-0.0331-0.00250.03650.0350.0104-0.0355-0.04110.4544-0.27170.16880.39370.00550.335648.5834-16.731583.3154
440.07220.01670.06870.00070.00620.0575-0.10120.0044-0.0704-0.03440.0374-0.05280.2453-0.077700.3549-0.04310.08190.2699-0.03610.304257.1145-12.05380.9222
450.00730.0009-0.00170.0166-0.00960.00460.00870.1176-0.0537-0.05170.02760.02320.2526-0.05330.02820.5697-0.10580.05610.2534-0.05080.318259.2645-16.738676.9527
460.0423-0.00710.0020.0026-0.00230.00410.0272-0.0443-0.00330.0445-0.0005-0.0150.03020.00060.00240.484-0.08490.03210.2524-0.05460.415160.0585-2.320296.5446
470.2948-0.11250.12790.0559-0.06420.0696-0.2089-0.0659-0.0850.01680.07-0.04570.066-0.1158-0.04140.5245-0.12270.08780.18880.00450.301254.08-13.980689.8908
480.0061-0.00070.00740.00530.00350.02230.0095-0.01540.04080.0048-0.0379-0.0333-0.0470.0164-0.01270.6357-0.39080.02950.37470.01630.36637.634243.401355.8287
490.0099-0.00180.00370.0068-0.00670.00560.0334-0.0722-0.02580.039-0.0015-0.0167-0.03010.03370.04750.5629-0.5737-0.10070.34540.11750.341337.190331.068766.256
500.0560.05810.07170.09980.03830.1088-0.0147-0.06930.05650.037-0.0758-0.0844-0.05490.013-0.0570.2728-0.3471-0.19930.3330.00460.065940.091634.59557.7182
510.0239-0.0018-0.01570.004-0.0020.01750.0754-0.04670.04780.0866-0.0486-0.1244-0.15930.1180.06980.3393-0.6221-0.02270.3920.05640.242138.629235.166249.1203
520.0031-0.00340.0050.006-0.0040.00320.03860.0808-0.00390.0657-0.03120.0432-0.028-0.017900.46970.06470.14610.41730.02830.53467.935526.347448.619
530.0067-0.0048-0.0070.0061-0.00120.032-0.01130.0014-0.00680.03240.01870.0311-0.00730.00440.00090.4275-0.15050.01660.2992-0.06870.486211.486125.48746.9285
540.0011-0.0008-0.00060.0065-0.00260.00460.00710.0214-0.002-0.01120.01120.0042-0.02840.0221-0.00280.2996-0.10830.12420.3116-0.01170.348524.976419.559235.0516
550.0048-0.0021-0.00250.0057-0.00320.0043-0.00460.0258-0.07030.03450.06040.0666-0.0354-0.03-00.3326-0.0589-0.07280.2464-0.02360.414716.490421.591640.9471
560.0021-0.004-0.00230.00080.00390.0015-0.0036-0.00850.07840.04080.04840.0143-0.01450.014100.4687-0.1640.05050.319-0.06410.2719.688632.150557.8209
570.00750.00630.00260.0054-0.0020.00280.03790.0121-0.07530.01270.01490.122-0.0065-0.00440.00660.3367-0.2564-0.04430.4117-0.05380.49579.717610.39745.8307
580.0167-0.01310.00180.0088-0.00290.0005-0.00930.02090.01090.0013-0.0056-0.0271-0.00760.0479-0.00270.3136-0.16210.09540.132-0.02810.363219.514316.949345.013
590.00240.00290.0014-0.0003-0.00140.00070.10540.0049-0.0924-0.0163-0.04560.05450.0035-0.0657-00.3615-0.0812-0.02450.259-0.06510.467715.378115.879238.3188
600.0370.0180.00870.0154-0.01480.04860.04270.08510.01060.09020.02470.0033-0.0548-0.05730.0120.2461-0.06790.03160.2791-0.06270.50099.575214.894248.8376
610.02640.0056-0.02190.0135-0.00550.01820.0394-0.04090.00160.01470.0082-0.0124-0.00260.02080.02280.4491-0.2987-0.04470.3322-0.00830.232527.523223.400861.7717
620.0163-0.0069-0.00120.00330.00010.00960.0113-0.0255-0.0784-0.02710.02650.05240.02890.01670.00990.5712-0.4088-0.01370.28150.02120.314923.788627.85168.7238
63-0.00180.00180.00330.01160.0010.00170.04930.10820.02890.1153-0.02870.0592-0.0071-0.057200.3108-0.1184-0.07470.48550.01340.50246.75818.160843.2667
640.03360.03120.04920.0935-0.01780.1368-0.0166-0.0837-0.0227-0.12540.01930.00730.02340.02960.0140.52010.2683-0.00730.5260.05340.415486.5065-17.635289.6845
650.03720.02450.04240.01250.02790.0479-0.05630.0464-0.06230.15510.18360.03850.010.05170.00080.360.07420.05830.28470.03730.340577.2067-11.034298.9198
660.15110.00230.16780.00420.00030.1959-0.00710.1001-0.07080.22450.1345-0.01880.1050.22610.07180.27650.06890.04150.20870.05040.203578.4535-11.841489.9395
670.00930.013-0.020.0184-0.0270.0420.0421-0.03690.00770.0110.00610.01650.03090.0380.01570.6356-0.06120.17120.33320.09120.411769.3565-24.3452104.2568
680.03260.0091-0.01160.0037-0.00720.0558-0.01410.01240.00370.0470.062-0.01860.08220.01330.0060.53640.0760.02310.18510.1140.439776.1263-22.204490.3402
690.0014-0.0015-0.0030.0032-0.00120.00020.01830.0537-0.1067-0.0061-0.04730.09180.0327-0.05640.00010.4021-0.0097-0.01860.30240.01910.264376.9106-2.814873.4072
70-0.0028-0.0007-0.00090.0008-0.00440.028-0.0432-0.0317-0.0244-0.00720.0099-0.01640.04140.0257-0.02750.60770.2543-0.02470.19360.04140.379880.5498-22.771595.7809
710.0058-0.0021-0.0019-0.0014-0.00010.0016-0.03130.04710.05520.02150.03540.01-0.04970.0489-00.3495-0.2098-0.00790.4733-0.03450.356286.673917.512483.5216
720.0972-0.0938-0.13330.15570.05290.2365-0.1294-0.13120.0228-0.1540.09370.0172-0.0190.1907-0.0260.1959-0.0782-0.06350.27370.0070.226379.53179.732579.5598
73-00.00150.00880.03730.02490.0683-0.08680.1135-0.0289-0.08630.0975-0.1076-0.20380.070.04090.3851-0.0421-0.04560.1760.01360.258675.94813.386981.0286
740.0016-0.00510.002-0.0026-0.00350.0183-0.00910.0114-0.029-0.0816-0.02620.0828-0.14080.036-0.02890.5443-0.0931-0.10060.17780.08260.354672.490523.324476.4669
750.3543-0.1601-0.00850.1748-0.03560.0532-0.0661-0.14060.0402-0.03820.21130.0258-0.14430.16770.03940.3036-0.03220.01840.2256-0.00820.272378.324810.381492.0179
760.0057-0.0020.00690.0069-0.00580.00540.07880.04960.0279-0.0125-0.0143-0.0147-0.05610.0008-00.2805-0.0621-0.06670.32930.06540.3298105.22734.878455.8504
770.0064-0.0157-0.00540.01670.0130.0096-0.0513-0.0236-0.01080.0196-0.086-0.0298-0.0879-0.0473-00.2603-0.0141-0.05760.48930.01890.4978104.2572-7.592666.0602
780.0066-0.0062-0.01550.01920.00850.03050.01390.01840.0662-0.02330.0179-0.1705-0.0363-0.04210.01210.1427-0.12840.00710.55740.08470.392104.0227-1.856851.0083
790.00720.0104-0.00590.0185-0.01240.075-0.0014-0.0367-0.00530.08960.026-0.1516-0.0185-0.0367-0.02090.154-0.0393-0.00890.38950.00740.3089105.171-6.377860.626
800.0078-0.01360.00670.0174-0.01820.02850.12430.0860.04870.1344-0.0367-0.0547-0.06560.04050.00040.2669-0.0606-0.04860.4321-0.02480.4529117.5426-3.490362.555
810.07150.0395-0.0070.12130.05130.05690.07740.20770.1360.0888-0.0143-0.2163-0.0438-0.00860.09980.0211-0.1403-0.07330.5179-0.0150.2439103.7281-4.184247.4651
820.0050.0054-0.00070.00760.00050.0003-0.0153-0.0225-0.00660.01830.02460.05780.0033-0.04050.00050.17340.05970.08060.6375-0.00630.299874.7331-10.378748.6271
830.03850.01630.01070.0334-0.01420.0184-0.0624-0.0279-0.0432-0.02480.0027-0.0624-0.0142-0.066-0.06990.131-0.1158-0.02560.8250.00880.348185.0315-15.482239.9908
840.0642-0.02150.04580.01-0.01430.0361-0.0622-0.0401-0.01920.00630.01980.07510.023-0.1075-0.02270.2567-0.05510.0250.5133-0.04030.180284.1796-11.461754.557
850.06120.0188-0.00680.0029-0.0010.0020.0268-0.0038-0.0983-0.0349-0.07250.04610.01610.0156-0.04310.2479-0.1139-0.0030.6726-0.09940.325781.1122-21.891640.53
860.01290.0033-0.00680.00690.00290.0045-0.01940.0234-0.04360.0055-0.0367-0.0490.0131-0.0244-0.01670.1243-0.16790.01910.7605-0.10520.429175.5204-21.812648.5922
870.0545-0.03970.05320.0268-0.03510.05930.0066-0.06680.0077-0.01760.11330.01240.0488-0.05360.00650.2561-0.0613-0.02040.5229-0.01820.227192.2233-11.855565.5582
880.00080.0018-0.00110.00460.00710.01650.0333-0.03150.00870.0115-0.06670.1091-0.0006-0.0197-0.01080.2133-0.1721-0.03640.6902-0.05710.432972.8427-18.05843.2415
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'C' and (resid 2 through 22 )C2 - 22
2X-RAY DIFFRACTION2chain 'C' and (resid 23 through 49 )C23 - 49
3X-RAY DIFFRACTION3chain 'C' and (resid 50 through 90 )C50 - 90
4X-RAY DIFFRACTION4chain 'C' and (resid 91 through 122 )C91 - 122
5X-RAY DIFFRACTION5chain 'C' and (resid 123 through 145 )C123 - 145
6X-RAY DIFFRACTION6chain 'C' and (resid 146 through 159 )C146 - 159
7X-RAY DIFFRACTION7chain 'D' and (resid 1 through 14 )D1 - 14
8X-RAY DIFFRACTION8chain 'D' and (resid 15 through 84 )D15 - 84
9X-RAY DIFFRACTION9chain 'D' and (resid 85 through 92 )D85 - 92
10X-RAY DIFFRACTION10chain 'D' and (resid 93 through 122 )D93 - 122
11X-RAY DIFFRACTION11chain 'D' and (resid 123 through 132 )D123 - 132
12X-RAY DIFFRACTION12chain 'D' and (resid 133 through 159 )D133 - 159
13X-RAY DIFFRACTION13chain 'A' and (resid 2 through 14 )A2 - 14
14X-RAY DIFFRACTION14chain 'A' and (resid 15 through 23 )A15 - 23
15X-RAY DIFFRACTION15chain 'A' and (resid 24 through 35 )A24 - 35
16X-RAY DIFFRACTION16chain 'A' and (resid 36 through 49 )A36 - 49
17X-RAY DIFFRACTION17chain 'A' and (resid 50 through 78 )A50 - 78
18X-RAY DIFFRACTION18chain 'A' and (resid 79 through 90 )A79 - 90
19X-RAY DIFFRACTION19chain 'A' and (resid 91 through 100 )A91 - 100
20X-RAY DIFFRACTION20chain 'A' and (resid 101 through 112 )A101 - 112
21X-RAY DIFFRACTION21chain 'A' and (resid 113 through 122 )A113 - 122
22X-RAY DIFFRACTION22chain 'A' and (resid 123 through 132 )A123 - 132
23X-RAY DIFFRACTION23chain 'A' and (resid 133 through 145 )A133 - 145
24X-RAY DIFFRACTION24chain 'A' and (resid 146 through 159 )A146 - 159
25X-RAY DIFFRACTION25chain 'B' and (resid 1 through 14 )B1 - 14
26X-RAY DIFFRACTION26chain 'B' and (resid 15 through 35 )B15 - 35
27X-RAY DIFFRACTION27chain 'B' and (resid 36 through 49 )B36 - 49
28X-RAY DIFFRACTION28chain 'B' and (resid 50 through 84 )B50 - 84
29X-RAY DIFFRACTION29chain 'B' and (resid 85 through 100 )B85 - 100
30X-RAY DIFFRACTION30chain 'B' and (resid 101 through 132 )B101 - 132
31X-RAY DIFFRACTION31chain 'B' and (resid 133 through 145 )B133 - 145
32X-RAY DIFFRACTION32chain 'B' and (resid 146 through 159 )B146 - 159
33X-RAY DIFFRACTION33chain 'E' and (resid 2 through 14 )E2 - 14
34X-RAY DIFFRACTION34chain 'E' and (resid 15 through 35 )E15 - 35
35X-RAY DIFFRACTION35chain 'E' and (resid 36 through 66 )E36 - 66
36X-RAY DIFFRACTION36chain 'E' and (resid 67 through 79 )E67 - 79
37X-RAY DIFFRACTION37chain 'E' and (resid 80 through 100 )E80 - 100
38X-RAY DIFFRACTION38chain 'E' and (resid 101 through 112 )E101 - 112
39X-RAY DIFFRACTION39chain 'E' and (resid 113 through 122 )E113 - 122
40X-RAY DIFFRACTION40chain 'E' and (resid 123 through 132 )E123 - 132
41X-RAY DIFFRACTION41chain 'E' and (resid 133 through 145 )E133 - 145
42X-RAY DIFFRACTION42chain 'E' and (resid 146 through 159 )E146 - 159
43X-RAY DIFFRACTION43chain 'F' and (resid 2 through 22 )F2 - 22
44X-RAY DIFFRACTION44chain 'F' and (resid 23 through 84 )F23 - 84
45X-RAY DIFFRACTION45chain 'F' and (resid 85 through 122 )F85 - 122
46X-RAY DIFFRACTION46chain 'F' and (resid 123 through 132 )F123 - 132
47X-RAY DIFFRACTION47chain 'F' and (resid 133 through 159 )F133 - 159
48X-RAY DIFFRACTION48chain 'G' and (resid 2 through 22 )G2 - 22
49X-RAY DIFFRACTION49chain 'G' and (resid 23 through 49 )G23 - 49
50X-RAY DIFFRACTION50chain 'G' and (resid 50 through 112 )G50 - 112
51X-RAY DIFFRACTION51chain 'G' and (resid 113 through 159 )G113 - 159
52X-RAY DIFFRACTION52chain 'H' and (resid 1 through 14 )H1 - 14
53X-RAY DIFFRACTION53chain 'H' and (resid 15 through 22 )H15 - 22
54X-RAY DIFFRACTION54chain 'H' and (resid 23 through 35 )H23 - 35
55X-RAY DIFFRACTION55chain 'H' and (resid 36 through 49 )H36 - 49
56X-RAY DIFFRACTION56chain 'H' and (resid 50 through 66 )H50 - 66
57X-RAY DIFFRACTION57chain 'H' and (resid 67 through 79 )H67 - 79
58X-RAY DIFFRACTION58chain 'H' and (resid 80 through 90 )H80 - 90
59X-RAY DIFFRACTION59chain 'H' and (resid 91 through 112 )H91 - 112
60X-RAY DIFFRACTION60chain 'H' and (resid 113 through 122 )H113 - 122
61X-RAY DIFFRACTION61chain 'H' and (resid 123 through 132 )H123 - 132
62X-RAY DIFFRACTION62chain 'H' and (resid 133 through 145 )H133 - 145
63X-RAY DIFFRACTION63chain 'H' and (resid 146 through 159 )H146 - 159
64X-RAY DIFFRACTION64chain 'I' and (resid 2 through 14 )I2 - 14
65X-RAY DIFFRACTION65chain 'I' and (resid 15 through 49 )I15 - 49
66X-RAY DIFFRACTION66chain 'I' and (resid 50 through 100 )I50 - 100
67X-RAY DIFFRACTION67chain 'I' and (resid 101 through 112 )I101 - 112
68X-RAY DIFFRACTION68chain 'I' and (resid 113 through 122 )I113 - 122
69X-RAY DIFFRACTION69chain 'I' and (resid 123 through 145 )I123 - 145
70X-RAY DIFFRACTION70chain 'I' and (resid 146 through 159 )I146 - 159
71X-RAY DIFFRACTION71chain 'J' and (resid 1 through 14 )J1 - 14
72X-RAY DIFFRACTION72chain 'J' and (resid 15 through 59 )J15 - 59
73X-RAY DIFFRACTION73chain 'J' and (resid 60 through 100 )J60 - 100
74X-RAY DIFFRACTION74chain 'J' and (resid 101 through 122 )J101 - 122
75X-RAY DIFFRACTION75chain 'J' and (resid 123 through 159 )J123 - 159
76X-RAY DIFFRACTION76chain 'K' and (resid 2 through 22 )K2 - 22
77X-RAY DIFFRACTION77chain 'K' and (resid 23 through 49 )K23 - 49
78X-RAY DIFFRACTION78chain 'K' and (resid 50 through 78 )K50 - 78
79X-RAY DIFFRACTION79chain 'K' and (resid 79 through 100 )K79 - 100
80X-RAY DIFFRACTION80chain 'K' and (resid 101 through 122 )K101 - 122
81X-RAY DIFFRACTION81chain 'K' and (resid 123 through 159 )K123 - 159
82X-RAY DIFFRACTION82chain 'L' and (resid 1 through 14 )L1 - 14
83X-RAY DIFFRACTION83chain 'L' and (resid 15 through 49 )L15 - 49
84X-RAY DIFFRACTION84chain 'L' and (resid 50 through 74 )L50 - 74
85X-RAY DIFFRACTION85chain 'L' and (resid 75 through 112 )L75 - 112
86X-RAY DIFFRACTION86chain 'L' and (resid 113 through 122 )L113 - 122
87X-RAY DIFFRACTION87chain 'L' and (resid 123 through 145 )L123 - 145
88X-RAY DIFFRACTION88chain 'L' and (resid 146 through 159 )L146 - 159

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万見について

-
お知らせ

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2022年2月9日: EMDBエントリの付随情報ファイルのフォーマットが新しくなりました

EMDBエントリの付随情報ファイルのフォーマットが新しくなりました

  • EMDBのヘッダファイルのバージョン3が、公式のフォーマットとなりました。
  • これまでは公式だったバージョン1.9は、アーカイブから削除されます。

関連情報:EMDBヘッダ

外部リンク:wwPDBはEMDBデータモデルのバージョン3へ移行します

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2020年8月12日: 新型コロナ情報

新型コロナ情報

URL: https://pdbj.org/emnavi/covid19.php

新ページ: EM Navigatorに新型コロナウイルスの特設ページを開設しました。

関連情報:Covid-19情報 / 2020年3月5日: 新型コロナウイルスの構造データ

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2020年3月5日: 新型コロナウイルスの構造データ

新型コロナウイルスの構造データ

関連情報:万見生物種 / 2020年8月12日: 新型コロナ情報

外部リンク:COVID-19特集ページ - PDBj / 今月の分子2020年2月:コロナウイルスプロテーアーゼ

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2019年1月31日: EMDBのIDの桁数の変更

EMDBのIDの桁数の変更

  • EMDBエントリに付与されているアクセスコード(EMDB-ID)は4桁の数字(例、EMD-1234)でしたが、間もなく枯渇します。これまでの4桁のID番号は4桁のまま変更されませんが、4桁の数字を使い切った後に発行されるIDは5桁以上の数字(例、EMD-12345)になります。5桁のIDは2019年の春頃から発行される見通しです。
  • EM Navigator/万見では、接頭語「EMD-」は省略されています。

関連情報:Q: 「EMD」とは何ですか? / 万見/EM NavigatorにおけるID/アクセスコードの表記

外部リンク:EMDB Accession Codes are Changing Soon! / PDBjへお問い合わせ

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2017年7月12日: PDB大規模アップデート

PDB大規模アップデート

  • 新バージョンのPDBx/mmCIF辞書形式に基づくデータがリリースされました。
  • 今回の更新はバージョン番号が4から5になる大規模なもので、全エントリデータの書き換えが行われる「Remediation」というアップデートに該当します。
  • このバージョンアップで、電子顕微鏡の実験手法に関する多くの項目の書式が改定されました(例:em_softwareなど)。
  • EM NavigatorとYorodumiでも、この改定に基づいた表示内容になります。

外部リンク:wwPDB Remediation / OneDepデータ基準に準拠した、より強化された内容のモデル構造ファイルが、PDBアーカイブで公開されました。

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万見 (Yorodumi)

幾万の構造データを、幾万の視点から

  • 万見(Yorodumi)は、EMDB/PDB/SASBDBなどの構造データを閲覧するためのページです。
  • EM Navigatorの詳細ページの後継、Omokage検索のフロントエンドも兼ねています。

関連情報:EMDB / PDB / SASBDB / 3つのデータバンクの比較 / 万見検索 / 2016年8月31日: 新しいEM Navigatorと万見 / 万見文献 / Jmol/JSmol / 機能・相同性情報 / 新しいEM Navigatorと万見の変更点

他の情報も見る