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- PDB-4zvz: Co-crystal structures of PP5 in complex with 5-methyl-7-oxabicycl... -

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基本情報

登録情報
データベース: PDB / ID: 4zvz
タイトルCo-crystal structures of PP5 in complex with 5-methyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
要素Serine/threonine-protein phosphatase 5
キーワードHydrolase/Hydrolase Inhibitor / Protein phosphatase 5 / Hydrolase-Hydrolase Inhibitor complex
機能・相同性
機能・相同性情報


response to arachidonate / peptidyl-threonine dephosphorylation / peptidyl-serine dephosphorylation / protein folding chaperone complex / response to morphine / protein serine/threonine phosphatase activity / histone H2AXS140 phosphatase activity / RNA polymerase II CTD heptapeptide repeat Y1 phosphatase activity / RNA polymerase II CTD heptapeptide repeat T4 phosphatase activity / RNA polymerase II CTD heptapeptide repeat S2 phosphatase activity ...response to arachidonate / peptidyl-threonine dephosphorylation / peptidyl-serine dephosphorylation / protein folding chaperone complex / response to morphine / protein serine/threonine phosphatase activity / histone H2AXS140 phosphatase activity / RNA polymerase II CTD heptapeptide repeat Y1 phosphatase activity / RNA polymerase II CTD heptapeptide repeat T4 phosphatase activity / RNA polymerase II CTD heptapeptide repeat S2 phosphatase activity / RNA polymerase II CTD heptapeptide repeat S5 phosphatase activity / RNA polymerase II CTD heptapeptide repeat S7 phosphatase activity / MAP kinase serine/threonine phosphatase activity / calmodulin-dependent protein phosphatase activity / myosin phosphatase activity / protein-serine/threonine phosphatase / phosphatase activity / phosphoprotein phosphatase activity / protein dephosphorylation / ESR-mediated signaling / Hsp90 protein binding / response to lead ion / ADP binding / tau protein binding / Negative regulation of MAPK pathway / MAPK cascade / double-strand break repair / mitotic cell cycle / Recruitment and ATM-mediated phosphorylation of repair and signaling proteins at DNA double strand breaks / positive regulation of canonical NF-kappaB signal transduction / intracellular membrane-bounded organelle / DNA-templated transcription / lipid binding / protein-containing complex / RNA binding / nucleoplasm / ATP binding / metal ion binding / identical protein binding / nucleus / plasma membrane / cytosol
類似検索 - 分子機能
PP5, C-terminal metallophosphatase domain / PPP domain / PPP5 TPR repeat region / : / Serine/threonine specific protein phosphatases signature. / Protein phosphatase 2A homologues, catalytic domain. / Serine/threonine-specific protein phosphatase/bis(5-nucleosyl)-tetraphosphatase / Metallo-dependent phosphatases / Purple Acid Phosphatase; chain A, domain 2 / Tetratricopeptide repeat ...PP5, C-terminal metallophosphatase domain / PPP domain / PPP5 TPR repeat region / : / Serine/threonine specific protein phosphatases signature. / Protein phosphatase 2A homologues, catalytic domain. / Serine/threonine-specific protein phosphatase/bis(5-nucleosyl)-tetraphosphatase / Metallo-dependent phosphatases / Purple Acid Phosphatase; chain A, domain 2 / Tetratricopeptide repeat / Calcineurin-like phosphoesterase domain, ApaH type / Calcineurin-like phosphoesterase / Metallo-dependent phosphatase-like / TPR repeat region circular profile. / TPR repeat profile. / Tetratricopeptide repeats / Tetratricopeptide repeat / 4-Layer Sandwich / Tetratricopeptide-like helical domain superfamily / Alpha Beta
類似検索 - ドメイン・相同性
Chem-4TF / : / DI(HYDROXYETHYL)ETHER / Serine/threonine-protein phosphatase 5
類似検索 - 構成要素
生物種Homo sapiens (ヒト)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 2 Å
データ登録者Chattopadhyay, D. / Swingle, M.R. / Salter, E.A. / Wierzbicki, A. / Honkanen, R.E.
引用
ジャーナル: Biochem. Pharmacol. / : 2016
タイトル: Crystal structures and mutagenesis of PPP-family ser/thr protein phosphatases elucidate the selectivity of cantharidin and novel norcantharidin-based inhibitors of PP5C.
著者: Chattopadhyay, D. / Swingle, M.R. / Salter, E.A. / Wood, E. / D'Arcy, B. / Zivanov, C. / Abney, K. / Musiyenko, A. / Rusin, S.F. / Kettenbach, A. / Yet, L. / Schroeder, C.E. / Golden, J.E. / ...著者: Chattopadhyay, D. / Swingle, M.R. / Salter, E.A. / Wood, E. / D'Arcy, B. / Zivanov, C. / Abney, K. / Musiyenko, A. / Rusin, S.F. / Kettenbach, A. / Yet, L. / Schroeder, C.E. / Golden, J.E. / Dunham, W.H. / Gingras, A.C. / Banerjee, S. / Forbes, D. / Wierzbicki, A. / Honkanen, R.E.
#1: ジャーナル: J.Biol.Chem. / : 2004
タイトル: Structural basis for the catalytic activity of human serine/threonine protein phosphatase-5.
著者: Swingle, M.R. / Honkanen, R.E. / Ciszak, E.M.
履歴
登録2015年5月18日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02016年4月27日Provider: repository / タイプ: Initial release
改定 1.12017年2月8日Group: Database references
改定 1.22023年9月27日Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_conn / struct_ncs_dom_lim
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_symmetry / _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_label_asym_id / _struct_ncs_dom_lim.beg_label_comp_id / _struct_ncs_dom_lim.beg_label_seq_id / _struct_ncs_dom_lim.end_auth_comp_id / _struct_ncs_dom_lim.end_label_asym_id / _struct_ncs_dom_lim.end_label_comp_id / _struct_ncs_dom_lim.end_label_seq_id

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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: Serine/threonine-protein phosphatase 5
B: Serine/threonine-protein phosphatase 5
C: Serine/threonine-protein phosphatase 5
D: Serine/threonine-protein phosphatase 5
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)153,25619
ポリマ-151,5484
非ポリマー1,70815
5,098283
1
A: Serine/threonine-protein phosphatase 5
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)38,2554
ポリマ-37,8871
非ポリマー3683
181
タイプ名称対称操作
identity operation1_555x,y,z1
手法PISA
2
B: Serine/threonine-protein phosphatase 5
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)38,2554
ポリマ-37,8871
非ポリマー3683
181
タイプ名称対称操作
identity operation1_555x,y,z1
手法PISA
3
C: Serine/threonine-protein phosphatase 5
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)38,3846
ポリマ-37,8871
非ポリマー4975
181
タイプ名称対称操作
identity operation1_555x,y,z1
手法PISA
4
D: Serine/threonine-protein phosphatase 5
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)38,3615
ポリマ-37,8871
非ポリマー4744
181
タイプ名称対称操作
identity operation1_555x,y,z1
手法PISA
単位格子
Length a, b, c (Å)40.858, 80.520, 91.165
Angle α, β, γ (deg.)88.15, 87.33, 86.71
Int Tables number1
Space group name H-MP1
非結晶学的対称性 (NCS)NCSドメイン:
IDEns-ID詳細
11A
21B
12A
22C
13A
23D
14B
24C
15B
25D
16C
26D

NCSドメイン領域:

Component-ID: _ / Refine code: _

Dom-IDEns-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11TYRTYRPROPROAA176 - 48610 - 320
21TYRTYRPROPROBB176 - 48610 - 320
12PROPROPROPROAA179 - 48613 - 320
22PROPROPROPROCC179 - 48613 - 320
13GLYGLYPROPROAA178 - 48612 - 320
23GLYGLYPROPRODD178 - 48612 - 320
14PROPROTYRTYRBB179 - 48913 - 323
24PROPROTYRTYRCC179 - 48913 - 323
15GLYGLYALAALABB178 - 48812 - 322
25GLYGLYALAALADD178 - 48812 - 322
16PROPROTYRTYRCC179 - 48913 - 323
26PROPROTYRTYRDD179 - 48913 - 323

NCSアンサンブル:
ID
1
2
3
4
5
6

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要素

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タンパク質 , 1種, 4分子 ABCD

#1: タンパク質
Serine/threonine-protein phosphatase 5 / PP5 / Protein phosphatase T / PPT


分子量: 37887.020 Da / 分子数: 4 / 断片: UNP residues 169-499 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: PPP5C, PPP5 / プラスミド: pMal2cE / 発現宿主: Escherichia coli (大腸菌)
参照: UniProt: P53041, protein-serine/threonine phosphatase

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非ポリマー , 5種, 298分子

#2: 化合物
ChemComp-MN / MANGANESE (II) ION


分子量: 54.938 Da / 分子数: 8 / 由来タイプ: 合成 / : Mn
#3: 化合物
ChemComp-4TF / (1R,2S,3R,4S,5S)-5-(propoxymethyl)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid


分子量: 258.268 Da / 分子数: 4 / 由来タイプ: 合成 / : C12H18O6
#4: 化合物 ChemComp-NA / SODIUM ION / ナトリウムカチオン


分子量: 22.990 Da / 分子数: 1 / 由来タイプ: 合成 / : Na
#5: 化合物 ChemComp-PEG / DI(HYDROXYETHYL)ETHER / ジエチレングリコ-ル


分子量: 106.120 Da / 分子数: 2 / 由来タイプ: 合成 / : C4H10O3
#6: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 283 / 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: 1.97 Å3/Da / 溶媒含有率: 37.65 %
結晶化温度: 289 K / 手法: 蒸気拡散法, ハンギングドロップ法 / pH: 8 / 詳細: 25% MPD, 6% PEG, 10 mM Tris, pH 8.0

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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: APS / ビームライン: 24-ID-E / 波長: 0.97918 Å
検出器タイプ: DECTRIS PILATUS 6M / 検出器: PIXEL / 日付: 2014年4月9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: 0.97918 Å / 相対比: 1
反射解像度: 2→91.03 Å / Num. obs: 76635 / % possible obs: 97.9 % / 冗長度: 2.4 % / CC1/2: 0.986 / Rmerge(I) obs: 0.086 / Rpim(I) all: 0.074 / Net I/σ(I): 11.7 / Num. measured all: 183306
反射 シェル

Diffraction-ID: 1 / 冗長度: 2.4 % / Rejects: _

解像度 (Å)Rmerge(I) obsMean I/σ(I) obsNum. measured allNum. unique allCC1/2Rpim(I) all% possible all
2-2.110.5052.126687110830.640.42196.8
6.32-91.030.0437.5578324330.9910.03798.1

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位相決定

位相決定手法: 分子置換

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解析

ソフトウェア
名称バージョン分類
REFMAC5.6.0117精密化
Aimless0.1.27データスケーリング
PHENIX位相決定
PDB_EXTRACT3.15データ抽出
XDSデータ削減
精密化構造決定の手法: 分子置換
開始モデル: PDB entry 1s95
解像度: 2→91.03 Å / Cor.coef. Fo:Fc: 0.948 / Cor.coef. Fo:Fc free: 0.93 / SU B: 9.914 / SU ML: 0.142 / 交差検証法: THROUGHOUT / ESU R: 0.243 / ESU R Free: 0.182 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor反射数%反射Selection details
Rfree0.23517 3848 5 %RANDOM
Rwork0.20438 ---
obs0.20593 72774 97.86 %-
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
原子変位パラメータBiso mean: 33.285 Å2
Baniso -1Baniso -2Baniso -3
1--0.38 Å2-0.74 Å20.54 Å2
2--1.56 Å20.01 Å2
3----1.15 Å2
精密化ステップサイクル: LAST / 解像度: 2→91.03 Å
タンパク質核酸リガンド溶媒全体
原子数10032 0 95 283 10410
拘束条件
Refine-IDタイプDev idealDev ideal target
X-RAY DIFFRACTIONr_bond_refined_d0.0050.0210395
X-RAY DIFFRACTIONr_bond_other_d
X-RAY DIFFRACTIONr_angle_refined_deg1.0941.96314059
X-RAY DIFFRACTIONr_angle_other_deg
X-RAY DIFFRACTIONr_dihedral_angle_1_deg5.60251248
X-RAY DIFFRACTIONr_dihedral_angle_2_deg36.0724.715509
X-RAY DIFFRACTIONr_dihedral_angle_3_deg12.614151790
X-RAY DIFFRACTIONr_dihedral_angle_4_deg12.3541544
X-RAY DIFFRACTIONr_chiral_restr0.0750.21504
X-RAY DIFFRACTIONr_gen_planes_refined0.0040.0217940
X-RAY DIFFRACTIONr_gen_planes_other
X-RAY DIFFRACTIONr_nbd_refined
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it
X-RAY DIFFRACTIONr_mcangle_other
X-RAY DIFFRACTIONr_scbond_it
X-RAY DIFFRACTIONr_scbond_other
X-RAY DIFFRACTIONr_scangle_it
X-RAY DIFFRACTIONr_scangle_other
X-RAY DIFFRACTIONr_long_range_B_refined
X-RAY DIFFRACTIONr_long_range_B_other
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
Refine LS restraints NCS

Refine-ID: X-RAY DIFFRACTION / タイプ: interatomic distance / Weight position: 0.05

Ens-IDDom-IDAuth asym-IDRms dev position (Å)
11A4290.05
12B4290.05
21A4310.04
22C4310.04
31A4380.02
32D4380.02
41B4200.04
42C4200.04
51B4290.04
52D4290.04
61C4340.02
62D4340.02
LS精密化 シェル解像度: 2→2.052 Å / Total num. of bins used: 20
Rfactor反射数%反射
Rfree0.315 276 -
Rwork0.284 5362 -
obs--96.67 %
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)
118.6119-2.4747.15430.4098-1.40645.53950.1971-0.0148-0.1001-0.2355-0.10530.07011.34550.3532-0.09170.7160.0073-0.02690.2913-0.17150.420321.3284-10.936815.2607
23.46340.20220.24853.8348-0.99855.7484-0.04770.3358-0.3375-0.1876-0.00050.03910.584-0.20570.04810.1514-0.05690.03870.1944-0.08930.147426.9737-4.163116.4842
31.68290.24990.7420.98630.17515.27470.05420.0091-0.38320.08670.03820.06930.5751-0.5448-0.09250.1161-0.06280.02010.19790.0060.185821.1628-2.42134.4711
414.1216-19.7315-0.298729.885-4.584311.69150.2393-0.1305-0.7393-0.7351-0.70730.64811.79162.08440.4680.81010.2508-0.25190.43560.14280.460342.4111-7.176142.0575
53.6471-0.9478-0.39252.889-0.8635.229-0.11180.052-0.2490.00260.0610.01930.240.18110.05080.0188-0.00560.02460.0534-0.02710.098237.44182.381225.8128
62.85440.1623-0.54280.89580.82725.275-0.06880.1456-0.23030.0612-0.02730.04370.0745-0.16170.0960.0073-0.00330.01480.0419-0.01440.063228.88293.595429.4615
73.85941.10460.94341.0507-1.43174.2795-0.08440.01450.36510.12810.12380.1621-0.3985-0.5258-0.03940.0760.10530.00650.4428-0.01070.144917.353111.464523.5776
82.26151.0625-0.84980.69590.59236.15370.0836-0.18420.04420.0848-0.07950.0679-0.14720.1066-0.00410.14150.02150.06540.05650.01140.11728.97578.306843.1909
99.97383.40791.70011.22431.38411.2282-0.0647-0.3085-0.1066-0.0279-0.128-0.0141-0.2406-0.21170.19270.12130.02640.03010.08980.01810.066924.80049.403652.5162
100.2914-0.0554-0.68592.52851.18683.90040.2599-0.09230.18160.1077-0.19660.1696-0.8418-0.3308-0.06340.2963-0.02440.09810.2101-0.09190.226925.896218.318743.2654
112.577-0.75531.2973.538-0.08446.34980.1031-0.11550.5829-0.0699-0.06570.0598-0.94040.2021-0.03740.2991-0.08230.04860.193-0.05280.202833.164522.307346.2434
122.1689-0.5777-1.55981.5733-0.33595.3810.1431-0.3360.16820.1427-0.0612-0.1798-0.57210.8047-0.08190.1211-0.088-0.02590.2104-0.03810.142739.686913.479342.8778
133.54950.77190.49112.66771.50380.853-0.0134-0.38410.07310.02320.0722-0.097-0.01480.0598-0.05870.1845-0.13090.01770.18550.02160.122541.014914.245436.8928
143.3074-0.13050.86752.9716-1.18797.43430.0341-0.16480.04630.21270.016-0.1263-0.29730.5971-0.05010.0324-0.02080.03050.1801-0.0320.148743.70388.734630.5139
1529.7962-31.6676-15.837737.273118.61849.3073-0.15640.79370.28070.4249-0.67661.56480.1543-0.39060.8330.54950.02970.04530.48210.01330.973730.99615.650712.849
166.37590.08692.78721.24290.19291.26330.12510.11050.1785-0.1349-0.2660.2078-0.0688-0.03840.14090.53660.0271-0.01970.34940.05630.315116.29223.41658.8406
172.38160.3346-0.82441.3807-0.28413.85050.00950.05310.395-0.1007-0.02360.1196-0.45230.07360.0140.22360.0133-0.02540.10320.03640.158615.42517.693463.5021
180.0292-0.15870.22322.7706-0.39674.44650.021-0.03870.0150.1651-0.14760.1626-0.43110.06870.12660.3202-0.09870.02110.2889-0.06480.199810.647714.659385.6725
193.69950.7658-1.96512.38610.53496.4381-0.0947-0.02360.01650.04230.04450.23870.0388-0.55850.05020.08510.0088-0.02310.10580.01160.10195.81274.596570.8142
205.3423-0.2533-0.31481.0507-0.75083.73010.0655-0.07080.2573-0.0789-0.08810.1811-0.1761-0.40210.02260.1159-0.0046-0.00550.1427-0.00670.12295.75017.671872.9013
211.51370.4885-0.42392.0787-1.05743.94820.015-0.17660.14760.1839-0.11630.0294-0.3417-0.06260.10130.0894-0.0055-0.01460.09930.00630.09712.869110.351773.5747
220.5157-0.5622-1.5231.49570.89076.9172-0.1455-0.1893-0.09470.1783-0.1548-0.31670.22710.75080.30030.04930.04210.0390.33640.16390.310326.13793.598468.6744
231.70732.266-1.39073.0563-1.59143.89130.2315-0.2633-0.03310.3139-0.2865-0.1015-0.31390.51830.0550.1212-0.0366-0.03520.2848-0.00390.176219.43848.750780.5398
242.42510.8729-0.97921.4748-0.2284.84080.0865-0.32030.09510.4358-0.1488-0.11710.1543-0.07190.06230.2552-0.05680.01270.21470.01380.121711.1304-2.465391.7028
252.80280.7104-0.0981.5172-0.80621.81610.0984-0.3322-0.11070.4513-0.2465-0.27270.08030.30970.14810.2662-0.044-0.02260.29610.06020.165118.2634-1.757989.8478
265.38150.5551-2.82783.9033-1.01711.691-0.1249-0.1008-0.57250.2567-0.2211-0.34550.18420.14290.3460.46370.0175-0.02630.30620.05340.200513.2139-12.171990.4253
271.2708-0.6594-0.27041.6233-0.97386.62420.0878-0.1841-0.13410.1913-0.08930.15940.2477-0.36990.00150.1754-0.08290.02910.18080.01410.17344.5-5.056685.9446
280.59751.2031-1.44744.7479-6.57699.37560.1931-0.24480.00560.13450.05160.21680.0558-0.2238-0.24470.2611-0.07470.05470.25820.02510.16973.2851-6.728881.6992
292.67740.0955-1.06663.77851.13616.2526-0.1374-0.3196-0.3957-0.0935-0.06150.28630.3639-0.20850.19890.1249-0.0919-0.03590.22010.02890.15262.6688-2.785572.2197
302.80730.2994-1.78432.584-0.23242.7431-0.1822-0.204-0.0081-0.08660.01810.10760.3645-0.16680.16410.1797-0.0309-0.02990.2222-0.01250.15855.656-1.290167.996
3110.9524-0.71134.142423.9084-9.633715.6330.4073-0.23680.49890.5672-0.597-0.4847-0.08250.43830.18980.2833-0.02260.10660.1583-0.13860.35762.47463.827927.1405
323.70680.4979-1.05841.5186-0.20123.35140.1866-0.49050.37640.2662-0.1219-0.0449-0.2953-0.0729-0.06460.2158-0.03780.00860.1696-0.09660.2361.601355.443828.8861
331.7301-0.0717-1.46462.70460.87573.32390.14930.32650.5482-0.35210.02820.1319-0.35950.1796-0.17750.24680.0272-0.01780.23030.0870.31181.357252.94367.3171
343.80011.0232-1.83322.0083-0.78014.9260.2014-0.0266-0.07960.0899-0.0964-0.26490.07060.3593-0.10510.14570.032-0.06770.0917-0.00790.189710.101442.055618.6253
354.33480.3108-0.64821.76510.26533.35040.21390.17230.14410.3561-0.0321-0.3654-0.0730.3113-0.18180.13710.0242-0.03580.0736-0.00140.18969.813345.073117.9956
364.38741.32620.69763.09270.91663.23080.2018-0.18740.10320.1097-0.22930.1720.099-0.1730.02750.06390.02510.00480.0527-0.02950.1248-1.950544.944718.7427
375.0785-1.28422.047.343-3.39422.68680.137-0.33930.1146-0.0181-0.0290.741-0.0198-0.5135-0.1080.14340.00120.06310.2995-0.11550.2567-12.468348.450926.4316
382.67450.9105-0.31811.88130.06762.57940.08450.41250.1584-0.2617-0.04340.0341-0.13030.0947-0.04120.10120.0406-0.03330.1431-0.01240.1223-0.525444.06877.5798
393.6047-4.8555-0.599411.3271-0.63973.3562-0.00910.61210.2387-0.69090.07380.6581-0.0548-0.1482-0.06470.3992-0.0328-0.18640.49270.10880.3556-3.925539.84-4.6141
403.55980.2511.78010.76761.07442.14420.25380.5027-0.2817-0.2173-0.38080.2858-0.1026-0.29470.1270.26140.1047-0.15490.3257-0.10870.3447-9.479238.42445.5336
412.8760.2269-0.78292.98531.16893.4208-0.0660.2353-0.3431-0.18330.06820.25710.6418-0.0401-0.00220.33280.0606-0.05560.2319-0.09370.31-1.192625.06711.5799
422.3421.32130.47082.2519-1.37036.64980.0640.4071-0.3666-0.2306-0.0996-0.21410.51510.39260.03560.21540.1022-0.03520.1511-0.07690.27567.616331.76595.227
432.3505-0.6895-1.0124.15443.416211.81890.1440.3422-0.2818-0.1119-0.2213-0.26810.0670.11840.07730.15060.0895-0.06610.1151-0.03220.29948.696529.917910.9128
444.04110.3279-1.02984.81440.39693.4449-0.09010.1406-0.46340.03220.0289-0.17560.5690.03240.06120.22110.0831-0.13790.1425-0.02330.279410.237832.831318.0941
452.41380.8122-0.2272.0549-0.45024.2080.1374-0.3455-0.33970.3816-0.1080.11820.2246-0.0487-0.02940.30350.025-0.07830.10750.02680.28545.315635.092626.5193
466.27791.8157-0.248.7151.9420.51790.1917-0.2066-0.54250.8764-0.1719-0.25410.2796-0.0026-0.01990.5950.1145-0.05710.38140.06380.430232.75529.784671.5881
471.3003-0.13430.52610.85-0.34845.21470.1173-0.0754-0.20540.00210.0136-0.04250.49010.4414-0.13090.20230.0791-0.00160.18370.02050.220329.884438.356865.4387
482.7904-0.06951.29231.96971.66867.3481-0.0059-0.2347-0.139-0.08-0.0058-0.02780.1982-0.58350.01160.05150.02120.03390.11720.04190.156617.643145.4563.8561
493.18210.66221.12472.0524-0.36136.15320.0055-0.0479-0.2009-0.00980.03290.11060.32750.1125-0.03840.05350.04420.01880.09240.03080.107924.103143.514962.4798
500.6064-1.17850.33892.60390.62956.1489-0.1373-0.00560.2968-0.02560.1514-0.5264-1.2250.6585-0.01410.2827-0.1861-0.07860.38460.01680.367134.725457.396866.0747
5112.12470.1009-0.89010.5240.95141.82810.24010.31080.26390.04290.0226-0.12970.05270.0745-0.26270.13210.01740.03130.49960.00370.159139.970650.060972.4472
521.1173-0.9296-1.04710.98920.12264.55890.03060.02570.1193-0.1385-0.1093-0.1268-0.12210.54470.07870.2328-0.0884-0.01840.19750.04690.177529.19549.704949.0216
531.5432-0.1338-0.65490.82890.29482.90390.0490.2220.3117-0.2328-0.0764-0.1164-0.60070.49610.02740.3088-0.0945-0.00240.26040.05810.234329.977557.876847.069
541.45524.74841.347816.25494.4021.2542-0.2342-0.07830.283-0.5758-0.070.4628-0.3123-0.04430.30430.7149-0.0596-0.11970.30550.01220.475825.416366.668449.5987
551.3994-1.4819-0.11092.5581-1.13826.81380.05720.38620.0559-0.351-0.07970.168-0.5964-0.38960.02240.295-0.0776-0.07740.2510.07010.209118.490554.474541.3311
562.2176-2.20710.78692.90940.47232.4984-0.512-0.29610.09560.1941-0.0290.2117-0.7629-0.70890.5410.42790.1928-0.04950.3114-0.04650.343911.619158.682756.1988
572.9685-0.5932.74060.4496-1.85238.5310.03780.02330.0127-0.0290.16930.1273-0.3233-0.7495-0.20710.2770.0617-0.08950.11960.01420.24214.261855.695154.3187
583.0217-0.17090.82783.89621.7257.9348-0.31730.04820.1253-0.23230.12180.2568-0.3046-0.48110.19550.09050.07060.03650.24240.07330.228311.931350.530958.439
590.92311.19880.78422.06470.39649.3010.1039-0.1135-0.16760.22890.2293-0.0315-0.0011-0.5298-0.33320.12240.0920.05020.35640.06440.262111.024950.411166.785
6015.758916.5641-7.429117.4884-7.86143.5403-0.2040.08960.2199-0.24040.19730.01780.1107-0.15880.00670.72450.0335-0.00920.631-0.16870.705426.518158.408677.4836
精密化 TLSグループ
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A176 - 184
2X-RAY DIFFRACTION2A185 - 206
3X-RAY DIFFRACTION3A207 - 231
4X-RAY DIFFRACTION4A232 - 237
5X-RAY DIFFRACTION5A238 - 263
6X-RAY DIFFRACTION6A264 - 306
7X-RAY DIFFRACTION7A307 - 334
8X-RAY DIFFRACTION8A335 - 358
9X-RAY DIFFRACTION9A359 - 369
10X-RAY DIFFRACTION10A370 - 396
11X-RAY DIFFRACTION11A397 - 414
12X-RAY DIFFRACTION12A415 - 437
13X-RAY DIFFRACTION13A438 - 450
14X-RAY DIFFRACTION14A451 - 481
15X-RAY DIFFRACTION15A482 - 487
16X-RAY DIFFRACTION16B175 - 183
17X-RAY DIFFRACTION17B184 - 214
18X-RAY DIFFRACTION18B215 - 234
19X-RAY DIFFRACTION19B235 - 252
20X-RAY DIFFRACTION20B253 - 275
21X-RAY DIFFRACTION21B276 - 304
22X-RAY DIFFRACTION22B305 - 327
23X-RAY DIFFRACTION23B328 - 345
24X-RAY DIFFRACTION24B346 - 361
25X-RAY DIFFRACTION25B362 - 393
26X-RAY DIFFRACTION26B394 - 414
27X-RAY DIFFRACTION27B415 - 435
28X-RAY DIFFRACTION28B436 - 449
29X-RAY DIFFRACTION29B450 - 467
30X-RAY DIFFRACTION30B468 - 490
31X-RAY DIFFRACTION31C179 - 184
32X-RAY DIFFRACTION32C185 - 212
33X-RAY DIFFRACTION33C213 - 232
34X-RAY DIFFRACTION34C233 - 252
35X-RAY DIFFRACTION35C253 - 274
36X-RAY DIFFRACTION36C275 - 316
37X-RAY DIFFRACTION37C317 - 329
38X-RAY DIFFRACTION38C330 - 355
39X-RAY DIFFRACTION39C356 - 370
40X-RAY DIFFRACTION40C371 - 387
41X-RAY DIFFRACTION41C388 - 414
42X-RAY DIFFRACTION42C415 - 435
43X-RAY DIFFRACTION43C436 - 450
44X-RAY DIFFRACTION44C451 - 470
45X-RAY DIFFRACTION45C471 - 491
46X-RAY DIFFRACTION46D178 - 186
47X-RAY DIFFRACTION47D187 - 233
48X-RAY DIFFRACTION48D234 - 254
49X-RAY DIFFRACTION49D255 - 304
50X-RAY DIFFRACTION50D305 - 319
51X-RAY DIFFRACTION51D320 - 328
52X-RAY DIFFRACTION52D329 - 365
53X-RAY DIFFRACTION53D366 - 396
54X-RAY DIFFRACTION54D397 - 406
55X-RAY DIFFRACTION55D407 - 427
56X-RAY DIFFRACTION56D428 - 437
57X-RAY DIFFRACTION57D438 - 450
58X-RAY DIFFRACTION58D451 - 471
59X-RAY DIFFRACTION59D472 - 482
60X-RAY DIFFRACTION60D483 - 489

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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