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- PDB-5gm2: Crystal structure of methyltransferase TleD complexed with SAH an... -

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基本情報

登録情報
データベース: PDB / ID: 5gm2
タイトルCrystal structure of methyltransferase TleD complexed with SAH and teleocidin A1
要素O-methylransferase
キーワードTRANSFERASE / TleD / Teleocidin / methyltransferases / terpene cyclization
機能・相同性
機能・相同性情報


S-adenosylmethionine-dependent methyltransferase activity
類似検索 - 分子機能
: / Methyltransferase type 11 / Methyltransferase domain / Vaccinia Virus protein VP39 / S-adenosyl-L-methionine-dependent methyltransferase superfamily / Rossmann fold / 3-Layer(aba) Sandwich / Alpha Beta
類似検索 - ドメイン・相同性
S-ADENOSYL-L-HOMOCYSTEINE / Chem-TEX / O-methylransferase
類似検索 - 構成要素
生物種Streptomyces blastmyceticus (バクテリア)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 2.8 Å
データ登録者Yu, F. / Li, M.J. / Xu, C.Y. / Zhou, H. / Sun, B. / Wang, Z.J. / Xu, Q. / Xie, M.Y. / Zuo, G. / Huang, P. ...Yu, F. / Li, M.J. / Xu, C.Y. / Zhou, H. / Sun, B. / Wang, Z.J. / Xu, Q. / Xie, M.Y. / Zuo, G. / Huang, P. / Wang, Q.S. / He, J.H.
引用ジャーナル: Biochem.J. / : 2016
タイトル: Crystal structure and enantioselectivity of terpene cyclization in SAM-dependent methyltransferase TleD
著者: Yu, F. / Li, M.J. / Xu, C.Y. / Sun, B. / Zhou, H. / Wang, Z.J. / Xu, Q. / Xie, M.Y. / Zuo, G. / Huang, P. / Guo, H. / Wang, Q.S. / He, J.H.
履歴
登録2016年7月12日登録サイト: PDBJ / 処理サイト: PDBJ
改定 1.02016年9月28日Provider: repository / タイプ: Initial release
改定 1.12016年12月7日Group: Database references
改定 1.22024年3月20日Group: Data collection / Database references
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / citation / database_2
Item: _citation.journal_id_CSD / _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
A: O-methylransferase
B: O-methylransferase
C: O-methylransferase
D: O-methylransferase
E: O-methylransferase
F: O-methylransferase
G: O-methylransferase
H: O-methylransferase
I: O-methylransferase
J: O-methylransferase
K: O-methylransferase
L: O-methylransferase
M: O-methylransferase
N: O-methylransferase
O: O-methylransferase
P: O-methylransferase
Q: O-methylransferase
R: O-methylransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)605,61254
ポリマ-590,81618
非ポリマー14,79736
2,990166
1
A: O-methylransferase
B: O-methylransferase
C: O-methylransferase
D: O-methylransferase
E: O-methylransferase
F: O-methylransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)201,87118
ポリマ-196,9396
非ポリマー4,93212
1086
タイプ名称対称操作
identity operation1_555x,y,z1
2
G: O-methylransferase
H: O-methylransferase
I: O-methylransferase
J: O-methylransferase
K: O-methylransferase
L: O-methylransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)201,87118
ポリマ-196,9396
非ポリマー4,93212
1086
タイプ名称対称操作
identity operation1_555x,y,z1
3
M: O-methylransferase
N: O-methylransferase
O: O-methylransferase
P: O-methylransferase
Q: O-methylransferase
R: O-methylransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)201,87118
ポリマ-196,9396
非ポリマー4,93212
1086
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)257.459, 152.757, 154.171
Angle α, β, γ (deg.)90.00, 93.06, 90.00
Int Tables number5
Space group name H-MC121

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要素

#1: タンパク質
O-methylransferase / Methyltransferase TleD


分子量: 32823.102 Da / 分子数: 18 / 由来タイプ: 組換発現
由来: (組換発現) Streptomyces blastmyceticus (バクテリア)
遺伝子: tleD / 発現宿主: Escherichia coli (大腸菌) / 参照: UniProt: A0A077K7L1
#2: 化合物
ChemComp-SAH / S-ADENOSYL-L-HOMOCYSTEINE / S-アデノシルホモシステイン


タイプ: L-peptide linking / 分子量: 384.411 Da / 分子数: 18 / 由来タイプ: 組換発現 / : C14H20N6O5S
#3: 化合物
ChemComp-TEX / (2S,5S)-9-[(3R)-3,7-dimethylocta-1,6-dien-3-yl]-5-(hydroxymethyl)-1-methyl-2-(propan-2-yl)-1,2,4,5,6,8-hexahydro-3H-[1,4]diazonino[7,6,5-cd]indol-3-one / Teleocidin A 1 / リングビアトキシンA


分子量: 437.617 Da / 分子数: 18 / 由来タイプ: 組換発現 / : C27H39N3O2 / コメント: alkaloid, 毒素*YM
#4: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 166 / 由来タイプ: 天然 / : H2O

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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: 2.53 Å3/Da / 溶媒含有率: 51.43 %
結晶化温度: 291 K / 手法: 蒸気拡散法, ハンギングドロップ法 / pH: 8
詳細: 100 mM Tris-HCl, 18% PEG400, 14% PEG3350, 100 mM MgCl2, 2mM TCEP

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データ収集

回折平均測定温度: 100 K
放射光源由来: シンクロトロン / サイト: SSRF / ビームライン: BL17U / 波長: 0.97915 Å
検出器タイプ: ADSC QUANTUM 315r / 検出器: CCD / 日付: 2015年5月7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: 0.97915 Å / 相対比: 1
反射解像度: 2.8→153.95 Å / Num. obs: 146088 / % possible obs: 99.8 % / 冗長度: 4.7 % / CC1/2: 0.999 / Rmerge(I) obs: 0.072 / Net I/σ(I): 16.5
反射 シェル解像度: 2.8→2.95 Å / 冗長度: 4.8 % / Rmerge(I) obs: 0.484 / Mean I/σ(I) obs: 3.3 / CC1/2: 0.846 / % possible all: 100

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解析

ソフトウェア
名称バージョン分類
PHENIX(1.10.1_2155: ???)精密化
XDSデータ削減
Aimlessデータスケーリング
PHASER位相決定
精密化構造決定の手法: 分子置換 / 解像度: 2.8→153.95 Å / SU ML: 0.4 / 交差検証法: FREE R-VALUE / σ(F): 1.35 / 位相誤差: 27.09
Rfactor反射数%反射
Rfree0.2487 7109 4.87 %
Rwork0.2066 --
obs0.2086 146088 99.78 %
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å
精密化ステップサイクル: LAST / 解像度: 2.8→153.95 Å
タンパク質核酸リガンド溶媒全体
原子数38443 0 576 166 39185
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.00339893
X-RAY DIFFRACTIONf_angle_d0.71354234
X-RAY DIFFRACTIONf_dihedral_angle_d14.88624501
X-RAY DIFFRACTIONf_chiral_restr0.0526113
X-RAY DIFFRACTIONf_plane_restr0.0046975
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)
10.7599-0.32470.59632.40661.06162.14130.06390.0157-0.24140.1204-0.0510.67710.5351-0.242-0.03840.79120.0348-0.18820.17390.06751.0193-95.538936.06272.8158
20.44520.4194-0.16221.3263-0.11920.3179-0.0299-0.0256-0.158-0.08560.0336-0.17870.08270.02560.10340.53150.0078-0.05460.0405-0.0330.6837-85.162859.470974.9179
30.2904-0.02680.01081.3368-0.0950.32830.0493-0.0246-0.09350.0128-0.0071-0.218-0.0390.0582-0.05610.4964-0.0062-0.08630.1136-0.06430.679-81.679873.085976.291
40.2786-0.0981-0.22490.3708-0.20440.41420.1385-0.02730.2758-0.15810.0026-0.0128-0.3322-0.0035-0.1830.6870.0576-0.07250.1532-0.13020.7661-87.009180.384376.0334
50.8763-0.02070.01880.8379-0.72440.62730.140.12420.3184-0.3726-0.05740.0056-0.0986-0.0502-0.09780.78540.1019-0.0930.1363-0.03080.6909-83.200474.672462.3105
67.34090.0611-4.22352.8523-0.56618.41680.40541.07140.0004-0.9188-0.09470.71950.069-0.4681-0.32020.99850.1851-0.50990.5107-0.12330.8919-100.403264.486951.9214
70.5084-0.63280.06172.0898-0.82510.43820.10260.20550.1723-0.6125-0.1493-0.0950.0245-0.07230.11360.91860.1416-0.1050.213-0.01170.707-83.377468.789355.1317
80.8042-0.3369-0.63164.314-0.07141.31010.1340.00740.02210.3007-0.03890.735-0.217-0.14770.10240.7165-0.0619-0.20430.1735-0.05280.8833-103.155157.991270.5557
92.22870.6494-0.34991.4519-0.21740.4601-0.18450.0888-0.1001-0.67480.04960.1055-0.0172-0.14240.15930.8450.0899-0.18760.1768-0.06010.7335-92.273763.368460.0896
101.34981.1254-1.17424.5568-3.52683.64450.10920.24570.3918-0.67650.05320.4111-0.3377-0.2228-0.16340.76770.0768-0.21220.19170.04490.8318-100.896472.593167.3743
110.8373-1.1661-0.62913.39131.40950.86760.0710.0928-0.1932-0.289-0.04070.23730.2091-0.04030.06950.6940.0393-0.18660.1678-0.03260.7053-87.53854.2266.8126
120.3855-0.48420.29680.6638-0.44640.3347-0.07110.03020.0908-0.0743-0.0388-0.0253-0.0777-0.02280.01070.67520.0378-0.2150.0655-0.0470.8316-84.154740.245669.3779
130.03580.1729-0.0151.19850.27340.32830.0649-0.0292-0.1455-0.04240.0804-0.2575-0.00690.0765-0.01020.76020.0576-0.18020.1809-0.09370.9717-80.216126.749868.9706
140.012-0.04340.03340.2985-0.2510.31480.06420.0711-0.3204-0.09910.08380.03770.3207-0.042-0.01680.84620.0055-0.23380.1950.00611.1496-85.897822.065674.0395
150.5729-0.83650.05811.28570.11970.7103-0.0262-0.3368-0.62910.11530.21920.86950.4148-0.3674-0.31490.871-0.00230.00030.42010.30451.2398-95.711932.041787.0499
163.57361.09962.81111.83430.19163.99290.08640.1831-0.3082-0.19560.12591.06840.1751-0.2733-0.23770.71860.0044-0.23190.24530.05431.1126-102.487541.7366.846
170.26570.07580.03682.45330.47841.0454-0.4457-0.0151-0.42530.30690.1420.849-0.2354-0.23570.11090.73710.0072-0.08980.23550.13621.1081-96.415536.091880.5115
182.1477-0.1776-0.1311.40470.19922.20.21410.62780.0514-0.7828-0.4205-0.54320.1370.22590.24311.19660.2160.26390.39680.12630.9165-56.50959.231647.6092
190.1281-0.0991-0.00610.7921-0.01670.2910.0019-0.02760.41470.1513-0.043-0.1611-0.20490.0349-0.05350.83730.06580.01290.1471-0.06261.2854-53.143868.609979.8054
200.9257-1.2495-0.0943.93580.34261.9503-0.0256-0.05790.33580.2186-0.02050.8099-0.6647-0.30630.03941.15930.08480.05610.5155-0.22172.0508-51.236981.134683.7022
210.53760.0876-0.01410.299-0.27720.26920.0882-0.01220.75330.03540.0329-0.6413-0.50370.1897-0.11520.90590.0625-0.04750.1241-0.22131.8797-38.080665.365777.1424
220.3958-0.21080.50512.5285-0.70260.8809-0.05540.11810.3949-0.4114-0.1273-0.5502-0.03120.1820.15530.85150.0190.02140.2463-0.13321.4987-37.836562.707770.6694
230.983-0.7580.11081.19520.05110.91590.12520.09090.2385-0.0427-0.0654-0.5275-0.27530.1182-0.21751.05680.12320.1410.20340.03160.9512-53.10256.808560.2014
244.6361-1.42110.63557.2353-0.39294.74830.36770.4741-0.7278-1.1926-0.0912-0.56920.39140.4583-0.29981.35620.34190.15460.5172-0.11670.8772-57.54139.513541.9547
253.62-0.0180.11982.17210.07770.49640.18280.7770.1199-1.2406-0.4214-0.4242-0.10310.0870.08381.3930.31040.12280.36620.06170.6905-65.635459.388543.8894
263.9692-0.439-0.33212.118-0.5941.36160.14970.38270.3654-0.8034-0.3929-0.4771-0.18220.29290.20541.25810.18050.16150.32920.13740.715-62.494564.57847.0002
274.4697-2.3825-1.11643.9891-0.29952.5276-0.2008-0.2811-0.0823-0.03860.4131-0.80480.46910.3519-0.13650.74470.1731-0.11780.2765-0.07270.8694-40.131521.757489.6198
281.3172-0.954-1.41135.64320.85642.0014-0.1254-0.36990.31810.14910.5346-0.4858-0.06180.1416-0.38160.6630.096-0.16430.235-0.12330.691-53.261540.12190.5458
292.1459-1.02550.12790.8908-0.25220.23320.25380.0240.2305-0.17430.0035-0.2021-0.07570.08-0.14170.76180.1752-0.15510.2841-0.19690.6597-65.088647.259795.7205
300.7083-0.27750.00021.2475-0.57320.6277-0.1126-0.36460.42760.5190.3232-0.1753-0.02650.0497-0.16891.16030.4376-0.22880.5074-0.17170.678-74.725555.9841101.2315
312.33392.10881.26192.61630.37132.4285-0.182-0.72370.63821.05830.3232-0.0636-0.5514-0.0207-0.1691.4090.4643-0.20290.7616-0.28940.7632-73.090157.264111.1589
323.29181.77520.93072.6177-1.79463.44570.0625-0.44350.30320.3238-0.073-0.0976-0.4152-0.6309-0.00970.90040.31330.00650.54120.01210.5758-84.572447.4524103.7817
338.4629-0.55856.5026.9282-1.55319.34230.3042-0.6796-0.47180.4576-0.03270.12031.1206-0.3658-0.28031.18260.37380.0660.84950.1860.632-74.823225.2437110.4147
341.5632-0.0012-0.36491.25070.18810.5493-0.2252-0.8882-0.67110.56910.40340.22580.47170.0943-0.22050.80850.34610.07150.58010.22940.7574-83.870836.355799.5902
353.921.02783.58310.32591.43067.57010.2425-0.5728-0.25430.63040.3811-0.40440.17010.0896-0.61841.05810.3618-0.19590.5314-0.01770.7008-58.123836.2051109.0633
360.61240.7990.3211.68551.15621.01310.2802-0.4615-0.51450.65080.26910.16050.44330.2227-0.4850.97820.3088-0.00730.54710.18610.6583-72.333733.8472103.9248
374.46552.3004-1.11744.3764-0.34533.62970.0894-0.77930.33850.8414-0.0775-0.11060.23180.225-0.04591.21190.372-0.2180.793-0.13940.6479-69.279442.0458116.0068
382.90880.34561.16754.22891.92134.1605-0.437-0.3855-0.07540.28490.2528-0.0386-0.2039-0.04650.20660.75520.2115-0.1180.26420.05790.6826-65.412737.40794.2977
390.08520.084-0.11021.3647-1.46911.58790.1587-0.00670.11690.19440.2840.2576-0.3393-0.1088-0.31130.57450.0453-0.06730.1192-0.02970.6358-56.350534.069283.1661
400.42860.1757-0.07140.10390.0990.53390.1410.01360.1971-0.17590.0276-0.0668-0.0476-0.0313-0.13510.67330.0096-0.090.0573-0.03110.6462-49.374528.832372.0785
410.4610.60560.01870.8473-0.07430.22210.0537-0.0105-0.0852-0.09580.0967-0.116-0.0160.0039-0.00740.7150.0279-0.10380.0848-0.02420.7607-45.630519.590974.264
420.2402-0.10050.08360.227-0.31180.44450.03420.02970.1007-0.22580.027-0.44010.16260.1489-0.08060.5970.04280.03370.0582-0.0810.9978-37.532234.366373.8666
433.98910.06471.38593.3341-3.29764.2778-0.432-0.23210.47150.92130.2768-1.458-0.56670.71530.15230.77140.1972-0.36860.7091-0.37371.5296-32.917336.260898.4536
440.2414-0.3509-0.15350.53370.13960.4096-0.0573-0.03830.06330.20490.0368-0.53410.01210.15770.01830.5708-0.0317-0.09710.1505-0.16981.0262-36.258642.827982.152
454.78090.0923-1.77582.4398-2.4935.6428-0.1191-0.6087-0.71110.17890.0189-0.61830.65160.21950.02180.64930.2392-0.23150.3553-0.01770.6881-50.064626.13598.7816
461.29630.3593-1.46192.4412-2.26854.14820.0892-0.35670.08080.39790.2984-0.4071-0.00340.3328-0.33270.62740.0996-0.22470.2409-0.2310.9215-41.543636.45191.6175
471.46-1.179-1.18612.702-1.89945.63-0.31730.9050.7201-1.01740.6455-0.9336-0.84760.3161-0.29681.3531-0.57690.36631.6757-0.00551.0222-26.19316.03766.8755
482.75571.22980.3712.4366-0.81933.837-0.64370.20410.0281-0.38990.52450.3262-0.9546-0.41560.09860.6680.101-0.02710.74690.26260.5372-38.351324.328629.7028
492.4189-1.14991.77991.952-0.75242.1416-0.27820.07690.6187-0.32120.32560.6529-1.3037-1.01350.00251.15570.4752-0.12041.1770.27220.8389-47.433332.798434.5682
500.9874-0.51850.67350.3282-0.30820.9779-0.4210.86560.8727-0.47820.0794-0.0692-0.9445-0.04160.27261.7792-0.0198-0.11141.00040.53490.8536-31.700138.092523.0751
513.2626-1.2511.62921.8408-1.75865.2789-0.18221.29060.6496-0.89480.29630.3432-0.7153-0.1642-0.09061.8187-0.2447-0.09060.96360.43170.8649-29.561137.16218.2749
520.8364-0.0947-0.81371.9883-0.24431.1784-0.24740.39560.5061-0.62470.40190.2434-0.7836-0.2026-0.13441.58940.0183-0.0891.37990.40940.6848-35.898832.627917.9317
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681.62430.1181-0.98323.82830.43552.5445-0.15240.2269-1.4278-0.06330.1508-0.92971.41230.75940.00071.24320.6184-0.13391.0522-0.3921.3282-8.6241-18.060149.7243
691.0628-0.0326-1.48933.50450.30162.2874-0.12910.5633-1.0244-0.37460.1509-0.39531.25940.39790.08451.24310.4795-0.09650.9227-0.58051.2876-14.2309-23.996738.2131
702.22170.76070.20811.2893-0.18456.3221-0.12-0.032-0.32510.0865-0.0638-0.27010.04840.76420.26590.37580.0109-0.13180.3955-0.09210.6133-16.619710.171964.1953
711.9215-0.5548-0.00531.85590.41371.6501-0.06910.988-0.1171-0.77750.3407-1.0643-0.44180.9885-0.26250.6701-0.33470.21611.7586-0.06590.8818-1.203420.476932.8728
722.9522-0.7291-0.39441.6432-0.34152.6119-0.36630.84660.7647-0.71480.3666-1.2884-0.69081.77830.07961.2005-0.6510.17731.87410.01031.14562.96432.140228.765
732.7349-0.77820.57951.3201-0.41131.2845-0.16130.03811.0572-0.2525-0.0826-0.9001-1.32390.76610.29331.5132-0.5901-0.03591.09730.23621.023-9.84241.082639.0947
742.5228-1.6494-0.22941.8795-1.28122.5872-0.28950.04290.8005-0.16840.2781-0.9081-0.83910.67190.00590.9768-0.5378-0.04720.7748-0.0160.8872-7.430331.253146.9796
751.7631-0.3208-0.90214.15560.46493.1265-0.18380.8725-1.1985-0.63730.4114-0.67180.76591.4754-0.21151.28330.130.01941.2114-0.69571.1238-16.3887-17.403134.6193
765.1612-2.58760.9152.5866-1.77254.318-0.07730.31980.22950.50290.2933-1.11280.53730.271-0.23540.6057-0.0769-0.04310.7174-0.43270.7086-32.2811-8.902231.5385
774.71812.01410.31158.38821.72261.9887-0.20060.55910.0169-0.13820.5251-0.0490.621-0.3901-0.31270.5939-0.09310.07430.65510.02480.3307-45.4776-4.059929.5958
786.05230.11251.95866.92042.78237.68370.02640.1246-0.66491.15390.04060.63671.2633-1.4697-0.08771.0756-0.40410.2490.910.020.5984-51.8726-10.458735.2813
793.9323-0.45260.51574.46920.90643.9718-0.08680.9164-0.2712-0.5240.18840.49060.427-1.0126-0.12230.693-0.3460.03221.13990.00820.4833-47.8218-7.439916.784
806.10792.2245-2.1213.8459-4.31384.88060.02321.643-1.2086-1.52350.18660.04610.91490.0208-0.21571.4431-0.23950.07581.5341-0.6021.1375-34.8959-27.810710.8275
811.48470.6229-0.25824.9175-1.22222.7829-0.1720.8937-0.6628-0.56810.5395-0.29741.2956-0.0759-0.37931.1025-0.19870.01511.1213-0.52230.8219-34.5449-18.893219.3838
822.21321.331.21553.8173-1.88234.1279-0.38651.12551.2941-0.87240.00350.4553-0.8339-0.90770.3761.340.4414-0.11731.10570.32360.7979-100.992835.73515.13
834.9025-4.1948-0.47145.5060.2532.04210.41390.1907-0.0586-0.2162-0.10070.3294-0.5045-0.5105-0.26630.86320.1727-0.13230.40830.13140.4498-85.647728.123819.3717
843.9227-2.2012-0.28275.0441-0.2883.09750.2242-0.1790.1167-0.00850.1981-0.3366-0.3419-0.1088-0.38230.72410.0531-0.16090.27020.02180.4874-72.816923.521823.0499
852.8985-0.1155-1.63894.10632.34184.85130.1168-0.14780.53020.29150.2367-0.7854-0.79620.3959-0.35930.80640.0249-0.12630.3403-0.08240.6691-65.784428.111819.2817
861.7382-0.2835-0.42464.84760.9350.26050.21230.62740.7777-0.65320.1297-0.2065-0.8195-0.1583-0.24451.26250.15090.12860.49790.25690.7573-72.289433.55672.4206
871.7393-0.71710.29192.8193-0.01790.05410.23310.36250.7463-0.1624-0.0568-0.002-0.6967-0.1247-0.03261.26830.26190.07650.49540.23670.7221-80.932638.488110.049
883.35350.40610.66183.18530.89781.43940.08660.6070.843-0.13110.175-0.0056-1.0321-0.0258-0.11681.27110.1839-0.05540.5170.24030.7248-80.02637.765714.156
891.61511.8945-1.28272.82-1.35371.05630.3190.0101-0.1777-0.4208-0.3183-0.136-0.0763-0.2025-0.01791.07470.4404-0.19451.28440.34360.7083-103.530229.17159.9011
900.6198-0.39150.58391.1529-0.95851.1436-0.13530.16710.1455-0.10590.26050.3348-0.2413-0.4263-0.12831.35510.5127-0.40812.170.17330.9062-116.996526.55896.6622
910.6801-0.12270.71640.7255-0.26070.7751-0.19690.11510.2665-0.4799-0.08620.4603-0.4755-0.31580.221.45080.7318-0.45692.42330.22731.2205-123.253732.286410.026
923.84810.4605-0.05081.2370.40952.21640.07930.23140.9694-0.34840.1280.8475-1.0724-1.1938-0.17171.16770.6955-0.01891.7090.40320.9289-114.295738.36726.2807
931.18040.1304-0.04683.7577-1.64872.0189-0.0740.40670.7919-0.5595-0.012-0.072-0.8036-0.51140.10121.54430.77740.02941.20350.33740.9079-103.998943.668416.6984
942.52890.49711.81160.1463-0.12155.9252-0.05971.1263-0.3396-0.98830.20110.11610.305-0.3136-0.24461.57120.2049-0.30641.0879-0.16920.5383-81.62181.8372-10.2162
951.28930.3117-1.22960.73820.06952.96470.0580.1457-0.0330.04660.04040.02480.8192-0.1867-0.01090.89050.0114-0.23390.4226-0.12650.4209-81.4539-4.450520.7926
961.5565-0.164-1.26951.08780.39782.50140.0096-0.04360.01110.09970.0414-0.14240.83910.2367-0.03910.94430.0586-0.20540.3529-0.09780.4396-77.2631-5.069627.0851
974.24411.3892-1.11534.51770.72880.5906-0.1011-0.0539-0.51550.07990.0369-0.27291.24990.11830.08261.30440.0498-0.17970.4094-0.04840.5131-75.7666-13.529629.2343
982.0534-0.2705-0.29191.52890.06550.04130.02670.5681-1.0383-0.0943-0.30040.30890.643-0.33930.26651.596-0.2966-0.12460.6144-0.34570.8457-87.8992-23.312919.053
993.79050.5858-1.69581.9797-0.42953.6692-0.08140.5573-0.4456-0.5144-0.2954-0.06381.0949-0.03740.19981.34160.1227-0.13970.5033-0.18240.4097-78.0085-13.48898.2427
1002.3002-0.8001-1.04371.051.50782.3485-0.0690.5946-0.5144-0.3319-0.40080.32270.868-0.47420.35911.6082-0.1436-0.17030.5581-0.21260.6874-83.9516-18.86210.4146
1012.8418-0.2982-0.17171.78430.64072.03310.01040.314-0.6202-0.0533-0.09180.03510.8748-0.21240.07071.49420.101-0.17990.5738-0.20520.525-77.9922-13.891211.722
1020.3933-0.2698-0.17292.00170.15360.0782-0.17940.31460.12980.050.09470.026-0.1985-0.41260.15721.14470.0569-0.44150.888-0.09360.5172-90.78883.0661-2.1259
1031.2711-0.2850.16820.24680.10371.80370.17960.8882-0.0167-1.0162-0.14240.3689-0.0886-0.5747-0.00621.59730.2334-0.47181.56540.00180.5726-93.870413.2019-16.313
1043.25260.3142-0.56662.7404-0.11052.03640.31081.16220.1834-1.2155-0.0953-0.2671-0.0817-0.297-0.17851.38590.2198-0.04250.91680.13180.4076-74.551914.7681-10.2821
1053.17270.53930.7172.62310.11822.07320.00981.0205-0.5936-0.38660.2399-0.38390.6958-0.1366-0.1851.40760.2781-0.06670.9807-0.14020.3836-76.8475-0.1626-9.7194
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1074.1405-1.8272-1.16065.1715-0.10925.37140.20930.0502-0.01180.6102-0.05440.23610.0748-0.8164-0.13840.7237-0.0884-0.09910.31410.08750.4244-105.269719.963747.8188
1088.87061.7616-0.8026.38690.66954.91730.22240.5550.2786-0.2088-0.24351.3365-0.2824-1.9983-0.00090.5750.1579-0.09441.12640.02550.8558-116.576326.485142.2588
1094.1561-0.1077-0.1384.1662-0.85644.6329-0.16590.8275-0.53910.46350.13531.1170.7817-1.7752-0.07930.6328-0.15470.06671.0731-0.18670.6838-116.203110.426241.4192
1101.848-1.4071-0.93292.1555-0.28644.42290.06050.4411-0.31690.7044-0.05920.74040.196-0.989-0.04150.938-0.4726-0.0431.08030.06760.7922-112.63579.218843.371
1110.66430.4681-0.08851.01170.38490.30470.16010.2422-0.0801-0.3846-0.30310.72480.3056-0.25890.1971.2497-0.2844-0.61011.919-0.3571.1576-118.1891-3.247211.5215
1120.0103-0.0993-0.02150.94750.20350.04390.24310.2647-0.3688-0.3554-0.20580.65770.4243-0.59160.04071.7311-0.5787-0.43942.0151-0.69691.5683-115.6593-15.84527.4448
1131.27160.08560.01231.8918-0.5630.28940.4084-0.2759-0.79240.4399-0.44150.85770.8116-0.95780.18821.5039-0.9023-0.14561.7248-0.53691.3217-115.1532-15.766326.3702
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 10 through 53 )
2X-RAY DIFFRACTION2chain 'A' and (resid 54 through 73 )
3X-RAY DIFFRACTION3chain 'A' and (resid 74 through 109 )
4X-RAY DIFFRACTION4chain 'A' and (resid 110 through 147 )
5X-RAY DIFFRACTION5chain 'A' and (resid 148 through 184 )
6X-RAY DIFFRACTION6chain 'A' and (resid 185 through 199 )
7X-RAY DIFFRACTION7chain 'A' and (resid 200 through 228 )
8X-RAY DIFFRACTION8chain 'A' and (resid 229 through 255 )
9X-RAY DIFFRACTION9chain 'A' and (resid 256 through 290 )
10X-RAY DIFFRACTION10chain 'B' and (resid 9 through 31 )
11X-RAY DIFFRACTION11chain 'B' and (resid 32 through 53 )
12X-RAY DIFFRACTION12chain 'B' and (resid 54 through 73 )
13X-RAY DIFFRACTION13chain 'B' and (resid 74 through 109 )
14X-RAY DIFFRACTION14chain 'B' and (resid 110 through 184 )
15X-RAY DIFFRACTION15chain 'B' and (resid 185 through 228 )
16X-RAY DIFFRACTION16chain 'B' and (resid 229 through 255 )
17X-RAY DIFFRACTION17chain 'B' and (resid 256 through 290 )
18X-RAY DIFFRACTION18chain 'C' and (resid 11 through 53 )
19X-RAY DIFFRACTION19chain 'C' and (resid 54 through 109 )
20X-RAY DIFFRACTION20chain 'C' and (resid 110 through 133 )
21X-RAY DIFFRACTION21chain 'C' and (resid 134 through 255 )
22X-RAY DIFFRACTION22chain 'C' and (resid 256 through 289 )
23X-RAY DIFFRACTION23chain 'D' and (resid 10 through 109 )
24X-RAY DIFFRACTION24chain 'D' and (resid 110 through 133 )
25X-RAY DIFFRACTION25chain 'D' and (resid 134 through 255 )
26X-RAY DIFFRACTION26chain 'D' and (resid 256 through 290 )
27X-RAY DIFFRACTION27chain 'E' and (resid 11 through 31 )
28X-RAY DIFFRACTION28chain 'E' and (resid 32 through 53 )
29X-RAY DIFFRACTION29chain 'E' and (resid 54 through 73 )
30X-RAY DIFFRACTION30chain 'E' and (resid 74 through 109 )
31X-RAY DIFFRACTION31chain 'E' and (resid 110 through 138 )
32X-RAY DIFFRACTION32chain 'E' and (resid 139 through 184 )
33X-RAY DIFFRACTION33chain 'E' and (resid 185 through 199 )
34X-RAY DIFFRACTION34chain 'E' and (resid 200 through 228 )
35X-RAY DIFFRACTION35chain 'E' and (resid 229 through 255 )
36X-RAY DIFFRACTION36chain 'E' and (resid 256 through 289 )
37X-RAY DIFFRACTION37chain 'F' and (resid 11 through 31 )
38X-RAY DIFFRACTION38chain 'F' and (resid 32 through 53 )
39X-RAY DIFFRACTION39chain 'F' and (resid 54 through 73 )
40X-RAY DIFFRACTION40chain 'F' and (resid 74 through 109 )
41X-RAY DIFFRACTION41chain 'F' and (resid 110 through 138 )
42X-RAY DIFFRACTION42chain 'F' and (resid 139 through 184 )
43X-RAY DIFFRACTION43chain 'F' and (resid 185 through 199 )
44X-RAY DIFFRACTION44chain 'F' and (resid 200 through 228 )
45X-RAY DIFFRACTION45chain 'F' and (resid 229 through 255 )
46X-RAY DIFFRACTION46chain 'F' and (resid 256 through 289 )
47X-RAY DIFFRACTION47chain 'G' and (resid 24 through 53 )
48X-RAY DIFFRACTION48chain 'G' and (resid 54 through 109 )
49X-RAY DIFFRACTION49chain 'G' and (resid 110 through 147 )
50X-RAY DIFFRACTION50chain 'G' and (resid 148 through 255 )
51X-RAY DIFFRACTION51chain 'G' and (resid 256 through 289 )
52X-RAY DIFFRACTION52chain 'H' and (resid 10 through 53 )
53X-RAY DIFFRACTION53chain 'H' and (resid 54 through 109 )
54X-RAY DIFFRACTION54chain 'H' and (resid 110 through 138 )
55X-RAY DIFFRACTION55chain 'H' and (resid 139 through 199 )
56X-RAY DIFFRACTION56chain 'H' and (resid 200 through 290 )
57X-RAY DIFFRACTION57chain 'I' and (resid 24 through 53 )
58X-RAY DIFFRACTION58chain 'I' and (resid 54 through 73 )
59X-RAY DIFFRACTION59chain 'I' and (resid 74 through 109 )
60X-RAY DIFFRACTION60chain 'I' and (resid 110 through 147 )
61X-RAY DIFFRACTION61chain 'I' and (resid 148 through 218 )
62X-RAY DIFFRACTION62chain 'I' and (resid 219 through 255 )
63X-RAY DIFFRACTION63chain 'I' and (resid 256 through 289 )
64X-RAY DIFFRACTION64chain 'J' and (resid 11 through 31 )
65X-RAY DIFFRACTION65chain 'J' and (resid 32 through 53 )
66X-RAY DIFFRACTION66chain 'J' and (resid 54 through 73 )
67X-RAY DIFFRACTION67chain 'J' and (resid 74 through 175 )
68X-RAY DIFFRACTION68chain 'J' and (resid 176 through 228 )
69X-RAY DIFFRACTION69chain 'J' and (resid 229 through 289 )
70X-RAY DIFFRACTION70chain 'K' and (resid 3 through 53 )
71X-RAY DIFFRACTION71chain 'K' and (resid 54 through 109 )
72X-RAY DIFFRACTION72chain 'K' and (resid 110 through 184 )
73X-RAY DIFFRACTION73chain 'K' and (resid 185 through 228 )
74X-RAY DIFFRACTION74chain 'K' and (resid 229 through 289 )
75X-RAY DIFFRACTION75chain 'L' and (resid 24 through 53 )
76X-RAY DIFFRACTION76chain 'L' and (resid 54 through 73 )
77X-RAY DIFFRACTION77chain 'L' and (resid 74 through 109 )
78X-RAY DIFFRACTION78chain 'L' and (resid 110 through 133 )
79X-RAY DIFFRACTION79chain 'L' and (resid 134 through 184 )
80X-RAY DIFFRACTION80chain 'L' and (resid 185 through 199 )
81X-RAY DIFFRACTION81chain 'L' and (resid 200 through 289 )
82X-RAY DIFFRACTION82chain 'M' and (resid 26 through 53 )
83X-RAY DIFFRACTION83chain 'M' and (resid 54 through 73 )
84X-RAY DIFFRACTION84chain 'M' and (resid 74 through 109 )
85X-RAY DIFFRACTION85chain 'M' and (resid 110 through 170 )
86X-RAY DIFFRACTION86chain 'M' and (resid 171 through 218 )
87X-RAY DIFFRACTION87chain 'M' and (resid 219 through 289 )
88X-RAY DIFFRACTION88chain 'N' and (resid 11 through 53 )
89X-RAY DIFFRACTION89chain 'N' and (resid 54 through 73 )
90X-RAY DIFFRACTION90chain 'N' and (resid 74 through 109 )
91X-RAY DIFFRACTION91chain 'N' and (resid 110 through 175 )
92X-RAY DIFFRACTION92chain 'N' and (resid 176 through 228 )
93X-RAY DIFFRACTION93chain 'N' and (resid 229 through 288 )
94X-RAY DIFFRACTION94chain 'O' and (resid 11 through 53 )
95X-RAY DIFFRACTION95chain 'O' and (resid 54 through 89 )
96X-RAY DIFFRACTION96chain 'O' and (resid 90 through 109 )
97X-RAY DIFFRACTION97chain 'O' and (resid 110 through 159 )
98X-RAY DIFFRACTION98chain 'O' and (resid 160 through 218 )
99X-RAY DIFFRACTION99chain 'O' and (resid 219 through 255 )
100X-RAY DIFFRACTION100chain 'O' and (resid 256 through 289 )
101X-RAY DIFFRACTION101chain 'P' and (resid 11 through 53 )
102X-RAY DIFFRACTION102chain 'P' and (resid 54 through 73 )
103X-RAY DIFFRACTION103chain 'P' and (resid 74 through 175 )
104X-RAY DIFFRACTION104chain 'P' and (resid 176 through 228 )
105X-RAY DIFFRACTION105chain 'P' and (resid 229 through 289 )
106X-RAY DIFFRACTION106chain 'Q' and (resid 24 through 109 )
107X-RAY DIFFRACTION107chain 'Q' and (resid 110 through 199 )
108X-RAY DIFFRACTION108chain 'Q' and (resid 200 through 218 )
109X-RAY DIFFRACTION109chain 'Q' and (resid 219 through 289 )
110X-RAY DIFFRACTION110chain 'R' and (resid 10 through 53 )
111X-RAY DIFFRACTION111chain 'R' and (resid 54 through 122 )
112X-RAY DIFFRACTION112chain 'R' and (resid 123 through 184 )
113X-RAY DIFFRACTION113chain 'R' and (resid 185 through 289 )

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万見について

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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