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- PDB-5gm1: Crystal structure of methyltransferase TleD complexed with SAH -

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基本情報

登録情報
データベース: PDB / ID: 5gm1
タイトルCrystal structure of methyltransferase TleD complexed with SAH
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


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 / 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: 2.501 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.
資金援助 中国, 1件
組織認可番号
National Natural Science Foundation31570740 中国
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)598,12037
ポリマ-590,81618
非ポリマー7,30419
12,538696
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)199,62913
ポリマ-196,9396
非ポリマー2,6917
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)199,24512
ポリマ-196,9396
非ポリマー2,3066
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)199,24512
ポリマ-196,9396
非ポリマー2,3066
1086
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)259.621, 152.902, 154.793
Angle α, β, γ (deg.)90.00, 93.33, 90.00
Int Tables number5
Space group name H-MC121
Components on special symmetry positions
IDモデル要素
11H-404-

HOH

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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: 19 / 由来タイプ: 組換発現 / : C14H20N6O5S
#3: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 696 / 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: 2.46 Å3/Da / 溶媒含有率: 50.08 %
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: 0.97908 Å
検出器タイプ: ADSC QUANTUM 315r / 検出器: CCD / 日付: 2014年12月25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: 0.97908 Å / 相対比: 1
反射解像度: 2.5→154.53 Å / Num. obs: 205755 / % possible obs: 99 % / 冗長度: 5.4 % / CC1/2: 0.998 / Rmerge(I) obs: 0.08 / Net I/σ(I): 14.5
反射 シェル解像度: 2.5→2.64 Å / % possible all: 96.3

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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: 2.501→102.265 Å / SU ML: 0.35 / 交差検証法: FREE R-VALUE / σ(F): 1.35 / 位相誤差: 26.1
Rfactor反射数%反射
Rfree0.2481 10313 5.01 %
Rwork0.2075 --
obs0.2095 205755 98.95 %
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: 2.501→102.265 Å
タンパク質核酸リガンド溶媒全体
原子数39381 0 0 696 40077
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.00340346
X-RAY DIFFRACTIONf_angle_d0.59254810
X-RAY DIFFRACTIONf_dihedral_angle_d13.9223888
X-RAY DIFFRACTIONf_chiral_restr0.046180
X-RAY DIFFRACTIONf_plane_restr0.0037097
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)
10.91341.3430.62962.91781.63331.53260.1552-0.0247-0.2866-0.0115-0.1250.14470.0742-0.34430.02250.43780.0821-0.10010.290.04530.679533.2427-39.156273.2678
21.28740.23240.07180.90060.24990.6948-0.0575-0.1754-0.250.20480.0666-0.1405-0.08760.0801-0.02610.40070.04720.00570.2168-0.00680.40445.6752-7.457275.745
31.0984-0.399-0.86021.0076-0.04521.19680.17930.01220.2001-0.3127-0.1607-0.0039-0.23180.014-0.03020.47860.0702-0.01490.2195-0.01990.413843.5792.497269.383
46.0753-0.413-1.91972.48381.78536.89890.13340.64280.2109-0.4823-0.17950.1956-0.2969-0.12250.03550.70310.1219-0.27560.4818-0.0120.826228.4591-10.400252.6871
51.9779-0.3927-0.29841.79770.07380.84090.150.4957-0.1712-0.429-0.1470.39290.0187-0.24020.00770.57380.1046-0.12650.2571-0.04380.505335.6463-12.061161.629
61.94560.112-0.23993.1526-0.17741.7284-0.02780.2118-0.05-0.33160.02610.1373-0.1169-0.3894-0.06490.55830.1106-0.14160.30040.00970.586727.6645-2.97767.821
72.1568-0.6289-0.84772.95451.75582.43530.256-0.0514-0.3794-0.3536-0.10050.2140.4270.1837-0.24110.49730.0885-0.04530.23230.00560.500841.2499-20.854166.7306
81.5122-1.49131.82731.4604-1.77272.4201-0.1573-0.00350.0928-0.0775-0.146-0.0522-0.40030.01460.29880.53570.021-0.08710.241-0.03750.609744.7706-34.843669.2339
91.747-0.10170.12370.80240.0360.7953-0.20710.1712-0.20960.00120.1481-0.0815-0.01290.23540.02830.42120.0282-0.0440.2899-0.05540.645948.8685-48.236268.7645
101.59580.48340.14211.8625-0.19232.31920.04590.3276-0.5160.0218-0.0156-0.19560.25040.0010.01170.58030.0303-0.08260.3225-0.08450.624244.0999-55.59866.8408
110.1013-0.4833-0.05182.19740.13550.66740.1811-0.124-0.25510.2399-0.03070.16220.0026-0.2822-0.10830.4652-0.009-0.03340.3340.04780.689642.3982-50.366281.1731
123.85310.38340.98831.60971.71734.61820.2521-0.3284-0.23520.35960.01780.36610.4442-0.6362-0.19190.6222-0.02160.00440.51980.12111.127822.8042-40.734883.9069
131.1063-0.11260.18020.7220.24681.01030.0261-0.3985-0.35860.2024-0.20410.02910.2751-0.35380.08930.59970.03210.07620.31290.15340.690640.1822-45.012988.727
142.50240.77261.3831.92220.56872.01920.08650.05850.0713-0.3728-0.02540.4707-0.0452-0.38890.18250.49830.0416-0.15060.3520.02510.832426.4259-33.542666.7314
151.9786-0.28111.15031.18930.05811.94130.0415-0.1432-0.09760.0695-0.13190.48090.0001-0.40860.08430.51120.07050.03160.34480.12810.791131.908-38.591479.9586
161.1093-0.23230.32441.46040.04151.42070.08520.22810.3006-0.1107-0.0773-0.38160.07330.01510.04850.48050.04520.13190.22990.06940.646174.0019-10.743865.3181
171.16050.2738-0.28943.0327-1.23363.03640.014-0.14010.48370.65850.1448-0.1369-0.6768-0.0644-0.10970.7640.0445-0.15610.3651-0.14191.091781.46882.358487.6295
180.50610.07910.04121.235-0.34111.4379-0.1849-0.0550.44350.0777-0-1.0869-0.27130.63210.00330.60480.0178-0.12250.1529-0.1861.480393.5454-12.403180.0732
191.50040.0384-0.08171.6141-0.55071.4869-0.15050.25830.39240.11460.0052-0.8695-0.21590.13070.05730.50920.03360.05970.2865-0.02010.955788.1636-9.603668.4639
201.61190.86020.9862.05180.55582.00790.2954-0.03240.16820.38860.1509-0.84740.12420.1678-0.24560.7798-0.13760.16080.2985-0.0181.384291.96222.28672.6592
210.68620.17190.57435.92140.40941.2968-0.15730.16450.3918-0.57510.1873-0.24710.13350.0550.00150.48040.01670.16330.35080.07620.668779.9016-15.858466.6331
225.77611.7699-0.42851.5854-0.06360.6954-0.06-0.2818-0.25050.0163-0.1709-0.18550.0401-0.13290.2570.54750.05810.13120.32870.03220.512270.7824-23.047257.4958
230.80430.54920.11371.8976-0.35210.59450.15370.441-0.2859-0.1776-0.23620.11060.1831-0.05850.10570.80120.15360.05250.4319-0.0730.565663.975-31.926848.9198
242.0987-1.03110.21642.3756-0.33712.11980.32960.6204-0.4926-0.6251-0.21560.15130.1737-0.03150.08670.95310.20620.10820.5471-0.1190.598769.2406-33.448340.3722
251.71030.35820.03061.05610.26831.27570.19550.7102-0.3497-0.676-0.33890.1407-0.0498-0.05970.09050.89360.26650.00690.5283-0.11660.515355.931-23.562242.6819
264.2214-0.4605-2.37473.0511-0.11563.87630.08910.49620.1596-0.4168-0.1234-0.0125-0.2307-0.3253-0.00291.10880.17670.17750.76040.14530.639167.3863-1.499439.8163
271.16910.3009-0.34871.0075-0.03620.74140.27480.5196-0.0116-0.5946-0.3048-0.3057-0.15880.0470.03550.81970.13850.13980.47250.08440.543568.4115-12.321447.1295
283.53511.0465-0.97931.8229-0.3821.41710.07020.29340.2214-0.5451-0.1606-0.1762-0.08690.26720.1140.77460.1230.13860.41750.09790.455266.3967-10.445847.1622
295.04540.6778-1.33091.4699-0.79712.15630.1461-0.0313-0.18150.1210.2085-0.62470.00380.1111-0.26950.51780.1463-0.10970.2894-0.06840.681188.7705-53.120789.96
301.4568-0.3706-0.48725.18070.29771.6098-0.2407-0.44350.24490.12070.3232-0.3161-0.3969-0.3672-0.07980.41080.1516-0.04970.3229-0.03390.424675.5303-34.910990.6526
314.0326-1.15061.03350.4045-0.40190.41120.17320.31360.07260.32380.0723-0.0346-0.13070.0713-0.20550.65180.2114-0.02390.3498-0.05320.419663.6071-27.796695.7501
321.1602-0.10660.06871.0238-0.37151.0768-0.1018-0.41820.43230.10660.1047-0.0398-0.0863-0.08370.00990.89860.2554-0.05720.4346-0.04940.518953.882-19.1509101.2315
334.02761.5413-0.33713.00170.24132.3551-0.4383-0.47140.6360.53080.30010.136-0.3516-0.07340.0561.07950.2983-0.08430.5482-0.10810.512555.4041-17.8533111.1489
341.7786-0.57610.30312.1463-0.8582.31840.0213-0.1020.2052-0.0375-0.0912-0.1088-0.1719-0.52790.04960.72390.23810.03920.5695-0.00090.438845.5893-25.4151105.4816
351.2153-1.1431-0.04854.1034-0.34430.71940.1490.0122-0.08230.1394-0.4348-0.0137-0.137-0.33580.14330.71870.18920.08360.43680.01890.397442.6932-29.8379101.9826
361.89640.34121.96621.96670.25364.0021-0.0848-0.1441-0.06150.4633-0.12320.30280.0584-0.23340.10731.04680.18350.1230.79190.24080.584754.2366-48.8183110.3947
372.2235-0.04270.82950.87710.15051.16510.1004-0.3072-0.09490.49970.09560.06840.1523-0.0765-0.18690.73060.2040.06760.44310.11580.456457.0031-39.6909103.9467
386.42790.5288-1.46781.339-0.39792.42010.3063-0.476-0.00960.3658-0.07080.03450.3009-0.2046-0.23071.0970.2835-0.09240.610.01830.476658.5578-33.5612115.9347
391.88130.86190.88072.83832.11273.5155-0.2079-0.3459-0.15860.53190.1806-0.0891-0.3515-0.18030.05910.57450.16450.01850.37940.04530.370563.3099-37.675594.296
400.50260.1822-0.16110.9039-0.39872.2972-0.00210.15950.1109-0.29610.17140.0922-0.0801-0.3932-0.12280.38140.03380.04320.1614-0.00330.451976.8194-44.226776.6723
414.63651.18480.6443.33650.11322.2374-0.16750.0796-0.3077-0.39070.2332-0.32940.2945-0.0559-0.08810.4740.05160.05560.1343-0.04710.480383.4067-55.500674.594
421.64160.0609-0.08540.9799-0.47342.1651-0.0024-0.00870.1778-0.30770.0488-0.9890.05090.2219-0.02030.43720.02710.06840.2111-0.04790.782591.3448-40.700774.1032
430.87320.29160.65093.5839-0.90821.92920.15530.09610.03150.01250.0306-0.4249-0.0830.3568-0.22910.6840.1939-0.3560.5496-0.21921.111495.1649-39.134798.1938
440.2563-0.0673-0.20810.0754-0.11040.8153-0.1-0.13130.34390.1638-0.0274-0.8625-0.29950.49040.04710.4387-0.0063-0.03340.2968-0.10230.995492.6814-31.407881.528
450.7016-0.87450.09264.4304-1.44571.3311-0.1907-0.2555-0.15220.2555-0.0138-0.3780.3374-0.07570.18690.56940.1297-0.04550.4034-0.00570.397978.7115-48.792298.9997
461.2887-0.1553-0.211.9796-1.32.7037-0.138-0.35160.25970.47980.1437-0.777-0.25690.4005-0.12950.56830.0982-0.13080.3323-0.16530.626387.1941-38.446391.7787
470.354-0.1179-0.56660.6795-0.45771.6147-0.36510.6156-0.1376-0.91560.5424-0.1877-0.3735-0.1129-0.12690.9984-0.59530.20131.83120.11270.5921104.4681-60.88490.418
481.41920.04160.83780.61190.24331.9628-0.31950.26620.28560.06040.29390.2714-0.959-0.8360.03630.68080.20380.031.10210.3460.593688.5224-44.786432.329
490.5244-0.52230.47960.5372-0.43460.5728-0.31340.72060.7764-0.32640.28710.0892-1.3229-0.37390.23441.2779-0.0794-0.06611.28610.62010.700597.8935-37.115718.3897
501.1875-0.5378-0.18361.36380.98441.0528-0.10040.39270.4393-0.37910.23610.0594-0.36820.224-0.09090.853-0.12480.10820.90470.27720.5737104.5716-40.038730.6487
510.6253-0.21950.95211.4769-0.0491.5404-0.2121-0.0420.3432-0.14080.15450.2077-0.729-0.32710.14491.36570.3576-0.06311.67130.70610.87684.7641-35.680418.3395
522.5433-0.7344-0.41450.93530.4011.4711-0.09690.27350.2613-0.5120.40580.0794-0.36480.0357-0.18960.7525-0.15080.04131.31680.33290.5404102.4053-49.738417.9248
530.199-0.3071-0.02480.45310.04580.1340.01590.16170.08390.06930.16890.0538-0.26310.2127-0.15110.4059-0.50640.41041.81670.02930.4398109.9299-60.743811.8205
540.9879-0.196-0.16510.70550.0160.27520.02660.33590.063-0.58860.6328-0.7510.04950.14940.25360.4912-0.51660.49442.6044-0.57920.7369119.2282-70.27551.5862
550.23830.2182-0.30680.2406-0.26550.4061-0.27260.5076-0.1278-0.42280.4922-0.30370.45290.4685-0.06790.6898-0.30830.21441.9306-0.32820.6536109.2116-79.75250.9883
561.90231.13730.6744.9286-3.67424.77840.08840.3457-0.0402-0.44870.13380.0334-0.1479-0.1465-0.15520.8456-0.2988-0.00212.15680.25470.771591.176-66.3563-8.6682
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620.95830.45620.44881.09210.30882.04560.02720.3050.07020.00960.0060.18320.1878-0.2629-0.00490.20270.0063-0.04160.3794-0.06940.348196.8658-68.873255.843
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651.84810.36120.06761.6185-0.50731.61170.01460.2655-0.42640.3280.1503-0.0210.53490.2326-0.06050.42010.0731-0.00950.3219-0.10680.4086105.5821-80.630560.7622
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680.97210.1574-0.89274.61572.54064.87250.0560.09760.42910.4345-0.07470.2733-0.61550.51080.02310.3581-0.14-0.10610.5774-0.06330.4666116.7375-53.16964.5569
691.49841.19330.76343.72432.00162.74470.126-0.1277-0.22350.2667-0.0542-0.4675-0.01980.5861-0.04340.34370.0411-0.13570.5944-0.02990.4559118.2303-68.088562.4687
701.33460.9927-0.33294.7932-2.85414.11320.0143-0.53330.00390.3558-0.1925-0.0975-0.28860.01320.13190.38620.0159-0.07810.5682-0.06050.3052108.9739-63.480472.3415
712.7326-0.8442-1.48951.18880.78311.5739-0.09450.52880.0861-0.13930.1341-0.1755-0.16310.70980.01410.2765-0.0359-0.04820.7391-0.07180.4343117.4197-62.930151.3167
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730.52030.132-0.05640.6909-0.32511.1016-0.09230.43440.6359-0.16850.218-0.5838-0.84320.9521-0.15080.9062-0.5643-0.00431.45340.20881.0096128.8535-39.902133.2906
740.5468-0.491-0.47581.4784-0.48751.6321-0.19210.28960.728-0.1812-0.0008-0.4808-0.31970.40040.12560.6471-0.3412-0.07450.76980.14430.6242120.6321-46.17144.1196
751.0841-0.23560.25250.89380.06032.81280.06880.10560.4292-0.06740.4074-0.3754-0.21390.4722-0.48720.7987-0.376-0.05730.90580.01980.7186125.8542-41.882548.0534
761.8201-0.15620.10421.4580.5750.9011-0.06690.1103-0.3841-0.2764-0.0497-0.30250.2297-0.07710.08351.51740.64120.17361.352-0.51771.3997129.9883-104.718139.4494
772.0225-1.0103-1.41312.34670.45951.02380.01450.6337-0.3621-0.52060.359-0.42070.84810.5617-0.00620.87620.1698-0.05090.9846-0.46180.6835112.8476-91.853134.266
782.8818-2.56451.92427.2952-4.94395.7126-0.2670.45810.14860.03180.1937-0.51120.37570.44670.05120.4726-0.12260.01070.7637-0.18050.381997.0244-83.940131.7259
791.48380.0780.38591.07650.50111.2928-0.1030.50410.2274-0.05310.08450.25670.4672-0.67210.07380.513-0.28310.10461.03180.04530.480383.8324-79.199729.865
801.59190.1475-0.14642.21560.46153.6634-0.28940.383-0.1975-0.01930.2790.34380.1926-0.70010.03390.7496-0.48110.09571.1734-0.0120.561977.0041-86.315132.3116
810.91690.19710.04621.4720.00610.6869-0.16670.5095-0.0064-0.1940.28750.50230.4295-0.5342-0.04010.5132-0.43060.01361.55120.00190.545882.1697-81.811317.0664
821.77260.6985-1.28814.4221-0.53.02960.10670.4777-0.2399-0.53350.1321-0.16390.402-0.0902-0.12541.4468-0.28150.19591.451-0.45670.860194.5925-102.71310.5669
830.8493-0.0595-0.28930.2824-0.08681.5515-0.08170.3756-0.10230.1436-0.1910.03030.45470.2633-0.03010.8929-0.5479-0.09991.419-0.21810.550990.2865-89.87639.6538
841.53490.17360.06392.309-0.46652.4903-0.09820.7865-0.44780.06180.2627-0.17021.0209-0.0339-0.16510.8679-0.16190.00410.9766-0.31040.557695.7236-94.750622.187
850.79970.06630.23511.4471-0.20071.46030.07090.4699-0.25050.14160.25870.07331.1779-0.3262-0.2551.04-0.3070.02611.0185-0.32940.562693.2858-94.225425.2167
861.21381.65881.7632.68962.20412.6743-0.22890.29990.1834-0.3581-0.22340.23050.3003-0.17470.27280.59930.20260.10441.1809-0.50.7647117.0113-85.587929.9201
870.62740.15020.09790.2574-0.24380.4612-0.33630.6024-0.5347-0.25410.211-0.6850.73121.0890.03290.19241.00780.34761.6523-0.83680.8293132.7563-86.614636.5367
881.03111.10570.2322.55190.78441.6555-0.1113-0.0126-0.4892-0.0003-0.0928-0.15170.99280.36590.21621.16480.5862-0.15980.9618-0.2140.9929119.8355-98.542551.3219
891.08020.5676-0.1671.2829-0.00581.5345-0.11670.312-0.6387-0.12940.0986-0.3661.23690.47670.08970.99770.3753-0.00830.8846-0.36290.8332116.4046-97.00639.1285
900.37020.4678-0.3070.6739-0.17380.74250.14120.14190.20670.2892-0.08110.33730.0133-0.1682-0.06311.89981.1722-0.17062.34580.01941.192210.2341-26.282312.6153
911.2060.09731.52491.3549-0.87472.70380.04790.66410.5819-0.3821-0.21540.1992-0.7573-0.82770.07670.8370.53990.02691.27830.12740.586528.3241-39.015315.2841
921.4376-0.97090.08422.29270.2531.58950.06-0.10490.05330.11680.1265-0.0722-0.2869-0.3845-0.20660.47530.1164-0.04340.40230.07980.438951.2509-49.910221.6266
932.3571-0.3322-0.59372.50461.06532.32420.023-0.14180.44890.42240.125-0.6046-0.50680.2403-0.10770.52180.0696-0.06240.374-0.04780.535762.5179-46.58121.802
941.67250.03680.38561.13150.49261.03430.3010.52250.479-0.39390.0916-0.1712-0.9095-0.039-0.33890.71230.17130.18550.59020.13750.50458.0915-45.08283.7866
951.10780.34910.22394.63172.72642.30860.15850.2260.31930.21560.2951-0.0664-0.7772-0.1106-0.37441.09380.37550.14260.68770.13160.604244.275-28.718616.6256
961.5411-0.37420.13893.6840.85571.48180.23020.49460.3381-0.4482-0.14320.2003-0.8872-0.3103-0.08830.87250.3020.15060.68860.1710.559450.2793-37.78236.4317
971.93340.2098-0.28752.37440.2331.93610.25790.29180.3969-0.2090.0801-0.1753-0.8284-0.3162-0.3430.83990.2330.09990.53750.13360.583550.0239-37.541213.3044
981.0321-0.0805-0.49070.4043-0.0930.25560.13470.261-0.1275-0.46-0.2920.5447-0.2546-1.0493-0.0540.71310.5164-0.24852.0048-0.0260.71617.7614-47.10567.7614
990.0855-0.05160.06740.1207-0.12580.6988-0.02520.18380.3001-0.4754-0.30490.8181-0.823-1.22020.25020.99050.7864-0.26772.4302-0.14081.014410.2321-39.679216.9494
1000.85930.0883-0.35310.99440.05021.71980.29860.14840.3658-0.4254-0.37240.0416-1.0505-0.94610.01221.24380.76690.02711.40980.18850.786624.9979-30.778616.1004
1010.6998-0.0492-0.22681.70760.26812.16660.11890.3932-0.0361-0.1928-0.20820.07910.7625-0.53250.05560.5271-0.0182-0.09460.653-0.05790.323148.6645-76.84317.6035
1023.57361.0249-1.2262.4784-2.04541.89710.0696-0.57860.0040.5316-0.2818-0.19741.32680.14550.24491.122-0.0693-0.09620.5807-0.03820.324155.6471-87.537931.7291
1031.3294-0.33450.13611.96130.63390.28210.00060.4808-0.5221-0.0492-0.57420.23131.1502-0.3565-0.19841.8007-0.6783-0.00430.6141-0.29390.469442.2297-97.493919.7708
1041.8201-0.1971-0.27051.18-0.45141.05350.34040.2548-0.19020.0175-0.44630.04311.3113-0.29050.12011.1512-0.1891-0.06410.7222-0.1650.37848.3646-91.36579.4467
1051.4072-0.294-0.30921.770.09891.59750.01050.2261-0.375-0.028-0.00960.04351.3696-0.4233-0.03821.1429-0.0433-0.04160.677-0.11290.375151.0589-89.730411.9959
1060.4736-0.6725-0.06373.82830.07110.0969-0.0140.31690.0130.05730.12840.20420.1061-0.6732-0.10370.6990.0203-0.14641.1068-0.06320.419738.505-72.229-2.0871
1070.9534-0.0837-0.32690.72560.4420.89370.28660.42430.1591-1.0231-0.25150.4670.0613-0.6850.05091.06090.3169-0.36641.6391-0.05490.589334.2595-64.0043-16.2132
1080.96740.13840.81531.4146-1.12572.98440.13630.87880.3445-0.8242-0.18040.0925-0.5397-0.54170.09431.02650.3542-0.04311.05150.05980.466743.9291-54.3728-13.5067
1092.4299-1.189-1.80823.50482.24534.9561-0.22350.550.3188-0.56520.3011-0.2848-0.1478-0.12280.02920.9550.20480.18490.92110.04290.577462.7401-69.213-14.2616
1101.5551-0.4276-0.26260.7463-0.31061.05730.0920.630.0428-1.0467-0.1297-0.2068-0.0069-0.1879-0.00050.87040.12680.00840.83140.07190.314651.3159-69.6238-9.39
1111.9504-0.40310.30222.99930.46241.30280.00630.66320.0161-0.70190.1307-0.12620.1046-0.2254-0.09420.72070.15920.03870.86740.04630.293153.9007-68.7244-9.0121
1120.7432-0.3490.00611.6207-0.12420.0751-0.09680.9162-0.24660.3018-0.1410.29310.7532-1.41880.1960.7176-0.67340.08231.4776-0.29850.536920.9982-73.909132.3499
1132.3335-0.78250.09813.8739-0.252.9348-0.0115-0.09990.02580.7926-0.054-0.12910.6664-0.44260.07010.6545-0.0571-0.05150.4782-0.0150.346330.2682-57.836750.282
1140.9926-0.3277-0.03050.79510.64010.6233-0.02270.71280.11690.5246-0.35180.78510.4199-1.77090.07640.6041-0.27940.2071.6273-0.1390.714713.5221-58.777642.1685
1150.2645-0.06450.26562.45610.42930.7709-0.07740.45640.16620.9797-0.45920.66940.2042-0.8490.03620.7326-0.60220.22541.6097-0.12620.742816.1296-65.692143.4302
1160.72180.15260.42330.45820.00481.46860.16170.0393-0.1843-0.1067-0.27240.6270.0629-0.1091-0.15710.4569-0.4337-0.53882.8491-0.68380.589713.4967-78.438211.4928
1171.1294-0.3352-0.04063.1531-0.49170.8648-0.05110.31080.3899-0.23210.01270.25520.10030.20530.08530.9551-0.0656-0.33851.7856-0.22481.18321.7854-81.12076.1681
1181.6371.42590.17321.77840.10330.0230.1201-0.0907-0.37910.1866-0.24860.06480.0960.102-0.1781.3113-0.5699-0.16512.2335-0.7221.226115.0487-94.10986.3819
1190.1548-0.24540.06210.4862-0.10760.01270.15570.0067-0.95650.4989-0.24570.53140.6497-0.1932-0.04561.485-1.08570.13731.7958-0.65011.294419.9863-96.018121.8199
1200.77510.34020.62311.6052-0.250.69640.4282-0.4881-0.26970.5573-0.111.12110.1453-0.63130.60211.3305-1.30040.19932.1254-0.73041.113810.154-86.924828.9404
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 9 through 53 )
2X-RAY DIFFRACTION2chain 'A' and (resid 54 through 109 )
3X-RAY DIFFRACTION3chain 'A' and (resid 110 through 184 )
4X-RAY DIFFRACTION4chain 'A' and (resid 185 through 200 )
5X-RAY DIFFRACTION5chain 'A' and (resid 201 through 289 )
6X-RAY DIFFRACTION6chain 'B' and (resid 10 through 31 )
7X-RAY DIFFRACTION7chain 'B' and (resid 32 through 53 )
8X-RAY DIFFRACTION8chain 'B' and (resid 54 through 73 )
9X-RAY DIFFRACTION9chain 'B' and (resid 74 through 109 )
10X-RAY DIFFRACTION10chain 'B' and (resid 110 through 147 )
11X-RAY DIFFRACTION11chain 'B' and (resid 148 through 184 )
12X-RAY DIFFRACTION12chain 'B' and (resid 185 through 200 )
13X-RAY DIFFRACTION13chain 'B' and (resid 201 through 228 )
14X-RAY DIFFRACTION14chain 'B' and (resid 229 through 255 )
15X-RAY DIFFRACTION15chain 'B' and (resid 256 through 289 )
16X-RAY DIFFRACTION16chain 'C' and (resid 11 through 109 )
17X-RAY DIFFRACTION17chain 'C' and (resid 110 through 147 )
18X-RAY DIFFRACTION18chain 'C' and (resid 148 through 218 )
19X-RAY DIFFRACTION19chain 'C' and (resid 219 through 290 )
20X-RAY DIFFRACTION20chain 'D' and (resid 10 through 31 )
21X-RAY DIFFRACTION21chain 'D' and (resid 32 through 53 )
22X-RAY DIFFRACTION22chain 'D' and (resid 54 through 73 )
23X-RAY DIFFRACTION23chain 'D' and (resid 74 through 109 )
24X-RAY DIFFRACTION24chain 'D' and (resid 110 through 138 )
25X-RAY DIFFRACTION25chain 'D' and (resid 139 through 184 )
26X-RAY DIFFRACTION26chain 'D' and (resid 185 through 199 )
27X-RAY DIFFRACTION27chain 'D' and (resid 200 through 255 )
28X-RAY DIFFRACTION28chain 'D' and (resid 256 through 289 )
29X-RAY DIFFRACTION29chain 'E' and (resid 11 through 31 )
30X-RAY DIFFRACTION30chain 'E' and (resid 32 through 53 )
31X-RAY DIFFRACTION31chain 'E' and (resid 54 through 73 )
32X-RAY DIFFRACTION32chain 'E' and (resid 74 through 109 )
33X-RAY DIFFRACTION33chain 'E' and (resid 110 through 138 )
34X-RAY DIFFRACTION34chain 'E' and (resid 139 through 159 )
35X-RAY DIFFRACTION35chain 'E' and (resid 160 through 184 )
36X-RAY DIFFRACTION36chain 'E' and (resid 185 through 200 )
37X-RAY DIFFRACTION37chain 'E' and (resid 201 through 289 )
38X-RAY DIFFRACTION38chain 'F' and (resid 10 through 31 )
39X-RAY DIFFRACTION39chain 'F' and (resid 32 through 53 )
40X-RAY DIFFRACTION40chain 'F' and (resid 54 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 200 )
44X-RAY DIFFRACTION44chain 'F' and (resid 201 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 10 through 53 )
48X-RAY DIFFRACTION48chain 'G' and (resid 54 through 170 )
49X-RAY DIFFRACTION49chain 'G' and (resid 171 through 274 )
50X-RAY DIFFRACTION50chain 'G' and (resid 275 through 289 )
51X-RAY DIFFRACTION51chain 'H' and (resid 11 through 31 )
52X-RAY DIFFRACTION52chain 'H' and (resid 32 through 53 )
53X-RAY DIFFRACTION53chain 'H' and (resid 54 through 73 )
54X-RAY DIFFRACTION54chain 'H' and (resid 74 through 159 )
55X-RAY DIFFRACTION55chain 'H' and (resid 160 through 184 )
56X-RAY DIFFRACTION56chain 'H' and (resid 185 through 198 )
57X-RAY DIFFRACTION57chain 'H' and (resid 199 through 255 )
58X-RAY DIFFRACTION58chain 'H' and (resid 256 through 289 )
59X-RAY DIFFRACTION59chain 'I' and (resid 10 through 24 )
60X-RAY DIFFRACTION60chain 'I' and (resid 25 through 53 )
61X-RAY DIFFRACTION61chain 'I' and (resid 54 through 73 )
62X-RAY DIFFRACTION62chain 'I' and (resid 74 through 109 )
63X-RAY DIFFRACTION63chain 'I' and (resid 110 through 138 )
64X-RAY DIFFRACTION64chain 'I' and (resid 139 through 159 )
65X-RAY DIFFRACTION65chain 'I' and (resid 160 through 184 )
66X-RAY DIFFRACTION66chain 'I' and (resid 185 through 200 )
67X-RAY DIFFRACTION67chain 'I' and (resid 201 through 228 )
68X-RAY DIFFRACTION68chain 'I' and (resid 229 through 255 )
69X-RAY DIFFRACTION69chain 'I' and (resid 256 through 289 )
70X-RAY DIFFRACTION70chain 'J' and (resid 9 through 31 )
71X-RAY DIFFRACTION71chain 'J' and (resid 32 through 53 )
72X-RAY DIFFRACTION72chain 'J' and (resid 54 through 109 )
73X-RAY DIFFRACTION73chain 'J' and (resid 110 through 217 )
74X-RAY DIFFRACTION74chain 'J' and (resid 218 through 246 )
75X-RAY DIFFRACTION75chain 'J' and (resid 247 through 289 )
76X-RAY DIFFRACTION76chain 'K' and (resid 10 through 24 )
77X-RAY DIFFRACTION77chain 'K' and (resid 25 through 53 )
78X-RAY DIFFRACTION78chain 'K' and (resid 54 through 73 )
79X-RAY DIFFRACTION79chain 'K' and (resid 74 through 109 )
80X-RAY DIFFRACTION80chain 'K' and (resid 110 through 138 )
81X-RAY DIFFRACTION81chain 'K' and (resid 139 through 184 )
82X-RAY DIFFRACTION82chain 'K' and (resid 185 through 198 )
83X-RAY DIFFRACTION83chain 'K' and (resid 199 through 218 )
84X-RAY DIFFRACTION84chain 'K' and (resid 219 through 290 )
85X-RAY DIFFRACTION85chain 'L' and (resid 10 through 53 )
86X-RAY DIFFRACTION86chain 'L' and (resid 54 through 73 )
87X-RAY DIFFRACTION87chain 'L' and (resid 74 through 184 )
88X-RAY DIFFRACTION88chain 'L' and (resid 185 through 217 )
89X-RAY DIFFRACTION89chain 'L' and (resid 218 through 289 )
90X-RAY DIFFRACTION90chain 'M' and (resid 9 through 24 )
91X-RAY DIFFRACTION91chain 'M' and (resid 25 through 53 )
92X-RAY DIFFRACTION92chain 'M' and (resid 54 through 109 )
93X-RAY DIFFRACTION93chain 'M' and (resid 110 through 159 )
94X-RAY DIFFRACTION94chain 'M' and (resid 160 through 228 )
95X-RAY DIFFRACTION95chain 'M' and (resid 229 through 255 )
96X-RAY DIFFRACTION96chain 'M' and (resid 256 through 289 )
97X-RAY DIFFRACTION97chain 'N' and (resid 9 through 53 )
98X-RAY DIFFRACTION98chain 'N' and (resid 54 through 109 )
99X-RAY DIFFRACTION99chain 'N' and (resid 110 through 228 )
100X-RAY DIFFRACTION100chain 'N' and (resid 229 through 289 )
101X-RAY DIFFRACTION101chain 'O' and (resid 10 through 109 )
102X-RAY DIFFRACTION102chain 'O' and (resid 110 through 147 )
103X-RAY DIFFRACTION103chain 'O' and (resid 148 through 218 )
104X-RAY DIFFRACTION104chain 'O' and (resid 219 through 289 )
105X-RAY DIFFRACTION105chain 'P' and (resid 10 through 53 )
106X-RAY DIFFRACTION106chain 'P' and (resid 54 through 73 )
107X-RAY DIFFRACTION107chain 'P' and (resid 74 through 159 )
108X-RAY DIFFRACTION108chain 'P' and (resid 160 through 184 )
109X-RAY DIFFRACTION109chain 'P' and (resid 185 through 200 )
110X-RAY DIFFRACTION110chain 'P' and (resid 201 through 255 )
111X-RAY DIFFRACTION111chain 'P' and (resid 256 through 289 )
112X-RAY DIFFRACTION112chain 'Q' and (resid 9 through 109 )
113X-RAY DIFFRACTION113chain 'Q' and (resid 110 through 159 )
114X-RAY DIFFRACTION114chain 'Q' and (resid 160 through 289 )
115X-RAY DIFFRACTION115chain 'R' and (resid 9 through 53 )
116X-RAY DIFFRACTION116chain 'R' and (resid 54 through 109 )
117X-RAY DIFFRACTION117chain 'R' and (resid 110 through 133 )
118X-RAY DIFFRACTION118chain 'R' and (resid 134 through 175 )
119X-RAY DIFFRACTION119chain 'R' and (resid 176 through 228 )
120X-RAY DIFFRACTION120chain 'R' and (resid 229 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://pdbjlvh1.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