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- PDB-7u5y: Crystal structure of ribulose-phosphate 3-epimerase from Pseudomo... -

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基本情報

登録情報
データベース: PDB / ID: 7u5y
タイトルCrystal structure of ribulose-phosphate 3-epimerase from Pseudomonas aeruginosa
要素Ribulose-phosphate 3-epimeraseリブロース-5-リン酸-3-エピメラーゼ
キーワードISOMERASE (異性化酵素) / SSGCID / Ribulose-phosphate 3-epimerase (リブロース-5-リン酸-3-エピメラーゼ) / Pseudomonas aeruginosa (緑膿菌) / Structural Genomics (構造ゲノミクス) / Seattle Structural Genomics Center for Infectious Disease
機能・相同性
機能・相同性情報


: / リブロース-5-リン酸-3-エピメラーゼ / D-ribulose-phosphate 3-epimerase activity / pentose catabolic process / pentose-phosphate shunt, non-oxidative branch / metal ion binding / 細胞質基質
類似検索 - 分子機能
リブロース-5-リン酸-3-エピメラーゼ / Ribulose-phosphate 3-epimerase family signature 2. / Ribulose-phosphate 3-epimerase family signature 1. / Ribulose-phosphate 3-epimerase-like / Ribulose-phosphate 3 epimerase family / Ribulose-phosphate binding barrel / Aldolase-type TIM barrel
類似検索 - ドメイン・相同性
リブロース-5-リン酸-3-エピメラーゼ
類似検索 - 構成要素
生物種Pseudomonas aeruginosa (緑膿菌)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 2.55 Å
データ登録者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
資金援助 米国, 1件
組織認可番号
National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID)HHSN272201700059C 米国
引用ジャーナル: To be Published
タイトル: Crystal structure of ribulose-phosphate 3-epimerase from Pseudomonas aeruginosa
著者: Abendroth, J. / Davies, D.R. / Lorimer, D.D. / Horanyi, P.S. / Edwards, T.E.
履歴
登録2022年3月2日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02022年3月9日Provider: repository / タイプ: Initial release
改定 1.12023年10月18日Group: Data collection / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model

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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: Ribulose-phosphate 3-epimerase
B: Ribulose-phosphate 3-epimerase
C: Ribulose-phosphate 3-epimerase
D: Ribulose-phosphate 3-epimerase
E: Ribulose-phosphate 3-epimerase
F: Ribulose-phosphate 3-epimerase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)151,31012
ポリマ-150,9176
非ポリマー3926
2,450136
1


  • 登録構造と同一
  • 登録者が定義した集合体
  • 根拠: gel filtration
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)99.010, 110.130, 126.760
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121
Space group name HallP2ac2ab
Symmetry operation#1: x,y,z
#2: x+1/2,-y+1/2,-z
#3: -x,y+1/2,-z+1/2
#4: -x+1/2,-y,z+1/2
非結晶学的対称性 (NCS)NCSドメイン:
IDEns-ID詳細
d_1ens_1(chain "A" and (resid 1 through 20 or (resid 21...
d_2ens_1(chain "B" and (resid 1 through 163 or (resid 164...
d_3ens_1(chain "C" and (resid 1 through 20 or (resid 21...
d_4ens_1(chain "D" and (resid 1 through 20 or (resid 21...
d_5ens_1(chain "E" and (resid 1 through 20 or (resid 21...
d_6ens_1(chain "F" and (resid 1 through 20 or (resid 21...

NCSドメイン領域:
Dom-IDComponent-IDEns-IDBeg label comp-IDEnd label comp-IDLabel asym-IDLabel seq-ID
d_11ens_1METALAA6 - 225
d_21ens_1METALAC2 - 221
d_31ens_1METALAE1 - 220
d_41ens_1METALAG3 - 222
d_51ens_1METALAI3 - 222
d_61ens_1METALAK2 - 221

NCS oper:
IDCodeMatrixベクター
1given(-0.75863138371, 0.595534228445, 0.264229836319), (0.596812130119, 0.472539847658, 0.64847619364), (0.261330643043, 0.649649963539, -0.713905609924)-76.3906272818, -4.14445005865, 79.4386734698
2given(-0.734817305243, -0.645191553056, 0.20921612696), (-0.634235741918, 0.54428731867, -0.549086822286), (0.240392494868, -0.536170844601, -0.809155284115)-80.122772381, -6.56288787332, 75.8288240539
3given(0.19665678993, 0.669481654198, -0.716324243389), (-0.579426233475, -0.510009779579, -0.635732069896), (-0.790943327259, 0.540078086415, 0.287618347187)-0.640919272277, -6.78124564165, -0.985942057698
4given(0.0386358034379, -0.0299227918266, 0.998805236882), (-0.018938642137, -0.999393931201, -0.0292078433551), (0.999073872407, -0.0177875464511, -0.039179084529)-76.2412736776, -10.4873671111, 79.2066705791
5given(0.228834593225, -0.58810958086, -0.775733104776), (0.658510981187, -0.493364283054, 0.568291273787), (-0.716936549912, -0.640873470435, 0.274377802113)-3.97374211263, -3.78166519447, -4.07368842642

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要素

#1: タンパク質
Ribulose-phosphate 3-epimerase / リブロース-5-リン酸-3-エピメラーゼ


分子量: 25152.893 Da / 分子数: 6 / 由来タイプ: 組換発現
由来: (組換発現) Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1) (緑膿菌)
: ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1
遺伝子: rpe, PA0607 / プラスミド: PsaeA.18161.a.B1 / 発現宿主: Escherichia coli BL21(DE3) (大腸菌)
参照: UniProt: Q9I5T1, リブロース-5-リン酸-3-エピメラーゼ
#2: 化合物
ChemComp-ZN / ZINC ION


分子量: 65.409 Da / 分子数: 6 / 由来タイプ: 合成 / : Zn / タイプ: SUBJECT OF INVESTIGATION
#3: 水 ChemComp-HOH / water /


分子量: 18.015 Da / 分子数: 136 / 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: 2.3 Å3/Da / 溶媒含有率: 46.5 %
結晶化温度: 287 K / 手法: 蒸気拡散法, シッティングドロップ法 / pH: 8.5
詳細: Rigaku Reagents MCSG1 screen optimized around condition B8 (170 mM ammonium acetate, 25.6% w/v PEG4000, 15% v/v glycerol, 85 mM Tris-HCl/NaOH, pH 8.5) + 15 mg/mL PsaeA.18161.a.B1.PW38947, ...詳細: Rigaku Reagents MCSG1 screen optimized around condition B8 (170 mM ammonium acetate, 25.6% w/v PEG4000, 15% v/v glycerol, 85 mM Tris-HCl/NaOH, pH 8.5) + 15 mg/mL PsaeA.18161.a.B1.PW38947, tray 323518 c9, direct cryoprotection, puck: mzv8-9

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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: シンクロトロン / サイト: APS / ビームライン: 21-ID-F / 波長: 0.97872 Å
検出器タイプ: RAYONIX MX-300 / 検出器: CCD / 日付: 2021年9月16日 / 詳細: Beryllium Lenses
放射モノクロメーター: Diamond [111] / 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: 0.97872 Å / 相対比: 1
反射解像度: 2.55→50 Å / Num. obs: 45708 / % possible obs: 99.7 % / 冗長度: 6.065 % / Biso Wilson estimate: 62.073 Å2 / CC1/2: 0.999 / Rmerge(I) obs: 0.066 / Rrim(I) all: 0.072 / Χ2: 0.928 / Net I/σ(I): 16.77
反射 シェル

Diffraction-ID: 1

解像度 (Å)冗長度 (%)Rmerge(I) obsMean I/σ(I) obsNum. unique obsCC1/2Rrim(I) all% possible all
2.55-2.626.2250.5853.0733310.8670.63999.9
2.62-2.696.20.5113.5332590.8920.5699.8
2.69-2.776.2210.4454.0131720.9270.48799.9
2.77-2.856.2490.3275.2830870.9560.35899.9
2.85-2.946.2210.2387.0529780.9770.2699.8
2.94-3.056.2240.1878.8528960.9840.20599.9
3.05-3.166.1960.15210.5827950.9880.16699.5
3.16-3.296.1840.1113.8727010.9940.12199.9
3.29-3.446.1210.08717.1125930.9970.09599.8
3.44-3.616.0650.07420.3824510.9970.08199.4
3.61-3.85.9430.06223.5123610.9970.06899.6
3.8-4.035.9240.05526.0922200.9980.0699.3
4.03-4.315.9070.04928.5421150.9980.05499.5
4.31-4.665.8730.04531.8719660.9980.04999.7
4.66-5.15.840.04233.2618200.9980.04699.7
5.1-5.75.8650.04133.8916540.9980.04599.7
5.7-6.585.8350.0433.6814770.9980.04399.8
6.58-8.065.7410.03635.7212700.9990.03999.6
8.06-11.45.6420.03238.89920.9990.03599.3
11.4-505.0610.03236.995700.9980.03696

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解析

ソフトウェア
名称バージョン分類
XDSデータ削減
XSCALEデータスケーリング
PHENIX1.20.1精密化
PDB_EXTRACT3.27データ抽出
MoRDa位相決定
Cootモデル構築
精密化構造決定の手法: 分子置換
開始モデル: PDB entry 5UMF as per Morda
解像度: 2.55→48.03 Å / SU ML: 0.4053 / 交差検証法: FREE R-VALUE / σ(F): 1.34 / 位相誤差: 29.7454
立体化学のターゲット値: GeoStd + Monomer Library + CDL v1.2
Rfactor反射数%反射Selection details
Rfree0.2576 1985 4.34 %0
Rwork0.2031 43710 --
obs0.2054 45695 99.66 %-
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å / 溶媒モデル: FLAT BULK SOLVENT MODEL
原子変位パラメータBiso mean: 68.75 Å2
精密化ステップサイクル: LAST / 解像度: 2.55→48.03 Å
タンパク質核酸リガンド溶媒全体
原子数9840 0 6 136 9982
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.004510034
X-RAY DIFFRACTIONf_angle_d0.698413675
X-RAY DIFFRACTIONf_chiral_restr0.04991616
X-RAY DIFFRACTIONf_plane_restr0.00571801
X-RAY DIFFRACTIONf_dihedral_angle_d11.91483514
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDRefine-IDタイプRms dev position (Å)
ens_1d_2AX-RAY DIFFRACTIONTorsion NCS0.402066034275
ens_1d_3AX-RAY DIFFRACTIONTorsion NCS0.345743489456
ens_1d_4AX-RAY DIFFRACTIONTorsion NCS0.397245127724
ens_1d_5AX-RAY DIFFRACTIONTorsion NCS0.38102535251
ens_1d_6AX-RAY DIFFRACTIONTorsion NCS0.373511239647
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.55-2.610.36161440.3263061X-RAY DIFFRACTION99.88
2.61-2.680.39841460.31613090X-RAY DIFFRACTION99.75
2.68-2.760.40841420.29853091X-RAY DIFFRACTION99.85
2.76-2.850.30011600.27483062X-RAY DIFFRACTION99.85
2.85-2.950.31241470.26913082X-RAY DIFFRACTION99.81
2.95-3.070.3831400.27133092X-RAY DIFFRACTION99.88
3.07-3.210.3331270.28393111X-RAY DIFFRACTION99.57
3.21-3.380.32051580.22623076X-RAY DIFFRACTION99.75
3.38-3.590.26281180.21593120X-RAY DIFFRACTION99.48
3.59-3.870.24541390.19633120X-RAY DIFFRACTION99.48
3.87-4.260.19641270.17253156X-RAY DIFFRACTION99.39
4.26-4.880.20211490.14483146X-RAY DIFFRACTION99.64
4.88-6.140.19991340.16493197X-RAY DIFFRACTION99.85
6.14-48.030.23391540.17533306X-RAY DIFFRACTION99.17
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)
18.37710294643-1.40087304392-2.205845014721.506141385990.3747657143390.564242464730.04271470540320.1713108725510.289387655345-0.2819091966310.0119961770325-0.03732823128130.2353124266560.119195658322-0.01068482341440.8213943928820.0747152045788-0.1028690980970.5714995572920.01053125887050.328334823005-45.4408631853-4.31644171513.2628571628
22.055805114440.391519732249-0.06785286509223.15686074945-0.7155364290933.773623202990.1623758100090.2623110547160.10582247728-0.187752460530.08207088055880.3121113646560.616778375458-0.276127018845-0.1906251857950.4855681855980.0614328838285-0.1079643888710.386198913422-0.0005805133099760.464805537663-52.259658409-4.0169582608814.0518095062
32.63747812315-0.02725385285410.03870924328742.06068306752-0.9206409771092.701431178110.1017821409850.0966302907359-0.394709306221-0.322967737950.06179781658150.1932735945540.5238567018790.128428155429-0.1580816630840.6506409320360.0321672058178-0.1435457278650.371901637641-0.05534645479650.439312268573-42.4209599547-12.496495303117.2045078222
44.848035172251.87204775495-0.481896156640.856112050031-1.321668681828.333252894820.463988285784-0.08110179086230.126484494181-0.734431935763-0.3353268594050.301907020693-0.310290242774-0.448168569917-0.05806177710030.549125145398-0.0304164170896-0.03519585517370.410469983093-0.07653627997350.40076368226-36.9093581836-3.0220799179413.0750319425
52.646895851290.775636254075-0.236620423511.75166592539-0.006043382327142.807028866940.04378489627540.09467172928370.352634109033-0.31792819364-0.05344133603270.1176922457290.07306616393890.3048691835460.009716747522950.718681845760.0312014936428-0.03031276013750.525269807803-0.004125256817760.437616962046-38.0160572915-0.4298043965413.91561162347
62.68782903996-0.002195612380331.172272518292.94394184637-0.6988361298823.676525768360.2501165750321.552311387660.342425372189-0.867131922874-0.04207051984040.0807370860335-0.0192973796148-0.515432071008-0.2216474339380.9470512704980.124294843336-0.1112226283470.68603070290.05349661021530.575829048098-45.79860280282.37086112862-5.81967203601
75.74979401951-2.67850201406-1.675590174012.51226174186-0.2233215965263.39588495679-0.166177208583-0.391290769388-0.8332288193910.4660470438740.07065913086870.4644747496160.1450054094180.07170289835280.07530272824610.845606291017-0.140447652252-0.1429221834730.4997057813290.1175333962210.745377562659-38.8427656424-31.638673771159.6794819072
83.13731978439-0.02400854777450.470448831571.53360575198-0.3890328151262.666787585330.236564177308-0.229064082673-0.66580577732-0.03026314140430.004885593119180.2770778321090.666745597706-0.203871547928-0.2357183382860.616787510109-0.0838132681934-0.1743616952890.411966151010.04703874320610.636247486318-41.9568830766-26.930050549248.331915691
90.789006416578-1.494267281410.160030991522.72533345758-0.9350017371053.353652794650.165700095107-0.239617322966-0.473560887074-0.02767675360220.2118857343610.861276692993-0.232461913371-0.807090651554-0.3867426289120.515369029328-0.1039399064550.02823836136190.6786038222070.1777326057040.829381648415-54.228031865-18.822900557154.0546644236
103.56925689783-0.721335811898-2.197391111095.62259989067-1.275973534225.98160721732-0.185241104842-0.413058172960.2226883654250.4901706014030.210916567889-0.70775622446-0.5863598133920.697823457282-0.03748689673390.782103081728-0.0812303448818-0.01148229879310.6392436169260.08182673049880.669013852864-41.3966429089-17.384787099261.2058799542
112.81187280243-1.222468502690.7763292445223.85908015982-1.366856348254.561449164390.172959891576-0.663683176868-0.5393134793990.6195850969480.2413502354750.1689537053330.0810959330876-0.657795010327-0.4801103046860.806496399233-0.1883999789120.002296405238820.6040283169310.1413337421860.680243370047-46.6285859333-24.455852309166.1290879479
125.949066915470.479811495322-0.4500102084754.32237836142-3.841303095773.380365224650.496804074843-0.832601452573-0.7229828918810.610784791801-0.2580682233230.2031476737430.01507600796040.139841370802-0.1377359664841.40265207395-0.072034372623-0.3690371687270.7298089571360.2211800241160.956510167282-40.3350157401-34.499844729372.4626038905
132.02149302427-1.416914478430.5702568832041.76932308877-0.8506848617050.432546135225-0.54142819203-0.4428249611120.5300318385760.6845330948530.04882234134870.0519458900666-0.2900679462760.1113305924810.5353473257411.259560735270.103958651272-0.02783639731530.590950288749-0.07490514400580.408792258534-36.526686986522.698561856660.0260644936
142.003422758530.3730114051891.213112534323.626788543341.230750847121.47470531318-0.138083611535-0.0619745669524-0.06941697123320.3558172736320.08143790913930.0236183089596-0.9634223479650.0269779808130.03673865351650.7952603303880.0151381953751-0.05465727593590.3834544022270.004497947592050.316033809639-33.548344291710.792661393154.7076516106
155.384965186452.976125158791.283278116765.389741132480.4002038951223.089290205470.192202093767-0.445747787432-0.4297980172460.723581156883-0.288233779368-0.215073872561-0.172367711898-0.08555750379850.145432015870.6525621524130.03272954895560.04041992819250.4414446280070.05663553494970.410447803918-38.2386145545-0.75983770136959.2330615583
163.5401887091-2.180941634530.494734437112.00557904278-0.9162223973532.33997116265-0.389063734237-0.360799255352-0.1913229827030.5728084582420.1359827089770.503571890779-0.145679300558-0.239495431320.2133563385170.8633113863360.02659487794480.162111817010.529587455224-0.05065845922070.45515424307-47.50306505620.56067783981960.6094061113
173.255731511471.05532623101-2.980806669224.951627522941.018173746644.387490940690.4399037512380.3008849565860.108084634880.3057723857710.4157919510221.24285009248-1.46138108878-0.959928695243-0.5338682303680.7705256562850.1936396427260.1301404325480.5558996110480.03714868769840.462177206495-48.47056216698.5569657748857.5882915521
181.805192891210.3945466146960.6211174069133.871383888030.6212812864353.15440458295-0.18757367814-0.2473636384260.1560830901841.08296849060.2363079917140.864978388523-1.11780658504-0.644486974220.00310292338441.179840431260.3805495623330.1359904415040.8285138736390.002509757262920.54400690955-50.987699031214.947971263.6714601881
193.43887025776-2.26332710427-3.040097172093.745473177573.197388422534.4584643063-0.817780260304-0.734817458878-0.1086667880030.1129564053190.2686869687490.210942268103-0.3530110763030.3225963952440.8027030792871.843551494840.36844531866-0.2079008930150.672708059489-0.04435632232510.666886828894-47.885074230728.021394713567.1562878286
205.56039090050.383102258781.244171497485.299123848350.2558104331962.4207554471-0.4700655789320.7518030334230.296796104212-0.02433929417450.332384773479-0.426138807258-0.8240120882480.1678393099220.238860006680.810958151311-0.29512252093-0.178085493950.613832777140.09874546737030.542985082349-16.990724597119.907008552937.8248018711
212.21534230323-0.1692388823440.6675895805123.957512126420.1655585911151.7642707697-0.1847071978690.04488964485180.250270663210.04470104912550.126514064943-0.0479979884179-0.9262000968320.1654969018620.07150442950850.851822930364-0.0451133729394-0.09760328446620.4934200440660.001298863756520.355985425692-27.734218843317.610073004739.6556446644
224.059825995630.8218520417931.222521754594.23296688893-0.7611456344772.05104313088-0.03277305356270.342113592469-0.156837277185-0.176391167682-0.06963258588420.00377874443363-0.6721244806790.1537658455380.1201737269290.617339795402-0.04458643372150.003253468024830.440190546662-0.03090128789630.288653812705-28.46454411569.3633673348425.8648543829
236.921968428961.03722730006-0.3776902104855.758177959691.160803409732.009987308520.2697456142360.0438455640818-0.5990744563570.761179864361-0.282962327248-0.48829743089-0.3341987625750.8012019298850.008410957076030.570093198883-0.0575058498789-0.001987949827950.5098401306750.05306664748760.400684337034-19.28478231597.8637604814930.4181000676
244.715729919550.7729991134730.4143060352935.247884602841.654766553974.9424076355-0.1088733032670.56324838488-0.173611794123-0.1801323680040.0731605986047-0.922040932082-0.8238173176761.141683587410.03472884619240.5503499933-0.1953979230440.0004490948066510.6952928575930.0862335159360.564896820743-11.398357116612.949102377230.0221632833
255.57112260805-0.863486892149-2.176458920444.70819356945-3.658851418554.503740864180.112830179630.2343725835910.710700106859-0.657627035668-0.910403255848-0.0514361907773-0.9304119605320.1647044018640.8203247333411.00089278712-0.367439293659-0.2124269114170.9997012443870.04234014285930.818564217402-4.6477763891822.031520675435.3651147898
260.384356744349-0.6159328436951.021007684412.02750366548-2.585506162933.555003231910.372372241705-0.3018031249240.489223438894-0.08373435800010.588288931875-0.3118608632710.532215494775-2.04305976645-0.9115368349280.503148473014-0.147248875085-0.1462699164861.103435150270.2540355311040.856919309384-72.5157844362-6.0056137263930.4774355894
272.598312323810.950232158841.041469254310.776911458436-0.3580607132754.45003297144-0.002441877379070.2974096805330.660833978869-0.007016056224270.1294799534380.4474393563060.327449899804-0.782829623257-0.1933378450770.434647129342-0.0667429927055-0.160525531250.5774155807250.1064171686670.680775212512-64.1789457774-5.9290670760426.471768126
283.998674868940.8659351435812.303950103861.98708676697-0.3614151518364.74896804390.0881343040642-0.1585569168110.57518270436-0.1708069975520.05095266518020.382394725609-0.611540364429-0.785469798876-0.2341627921180.4182582262770.170609163034-0.05097393688450.618407816850.05575629849760.626594990845-60.83906637642.9424497804227.5962624088
292.55009564807-0.04388823302720.2946265381662.79997120581-1.31730361214.020042936-0.124861567843-0.3942082892410.1110051314170.09870961322320.390480417450.235394815274-0.238008927894-0.725219922422-0.2544397236850.4604893101260.145861620130.04924264296580.7190325521580.08600578427530.566103156208-61.2446319367-0.91586866611742.5093980288
303.931517170831.138987170741.388896991061.32530799336-1.188609257193.274717524940.328275095451-0.666336724804-0.1941514484560.3177911670910.308209462470.6854997333060.0780840583657-1.99334362212-0.5412298183970.4966737324020.01698930353590.07613981001351.304916032110.3016691966840.953035333382-73.3027678982-8.9889856726345.128753819
312.407610435991.418256929733.343145735754.257775786942.48670683428.83102503013-0.6229765263190.166130763093-0.687187505278-0.4165896389350.2894870556990.52293784560.692976146009-1.805394102240.3843287643930.537852625633-0.295086069499-0.00246766771491.16748170830.3182215978071.04814726191-74.5822276654-11.633807425830.2090288676
320.402729557357-0.00771169050528-0.40862800630.6323458904270.0714878844390.399357631513-0.449789696353-0.9180898610820.296175768194-0.0271563980070.2129918076781.030762529490.15315060048-0.4919067674730.1430038019370.281365527067-0.232807484054-0.08561980088282.301879013420.7620889375331.58774927522-83.2043556404-12.11110055132.2476915929
332.760005637551.12476860826-2.006386666933.37780921353-1.88279020284.521804165810.0637731840062-0.0250993854269-0.384004980049-1.29094607969-0.196859177763-0.4717004554971.271281122570.8051171185890.1326770137750.9819684038440.411522724552-0.1137923590720.754008651001-0.08230050824650.930477773192-15.0552671994-29.558602587532.9302596918
342.31632885522-1.057868847260.5533811098993.96740453056-1.599257813712.119538095510.5155107603670.270671827108-0.656006001052-0.215127367605-0.641547513132-0.8936096712520.7464448690760.5292093356120.1351144003040.7689008290060.20999282406-0.2668881669680.554966231095-0.04094887239950.890250266127-20.593899615-33.673454970541.3914361217
351.611213382611.61779238331-0.6729523140651.870377268660.1160299613812.236811014730.15856822717-0.114870564115-0.510398326260.160163688478-0.250964826041-0.4744161683030.2685725079220.5013998313610.1079771790910.5637134116180.0855552353188-0.1923514495880.4650337624520.05487552170980.649453182307-23.5978869894-19.225224392142.0221798539
364.14762339425-0.1908943195270.05186140788795.168286535630.143199343683.577767186260.388087655927-0.104077713887-0.247938013502-0.234862326918-0.195806048346-0.642203401277-0.08718154894150.355349963259-0.1917544870140.5819883902220.109268960514-0.03488333999970.4859048893720.03708068774240.505874006016-17.7039663147-11.107542173633.6204202309
370.339201451510.42734247871-0.2690760956726.55445685198-0.4873242805913.957913970520.165076761963-0.0167120177572-0.217578877696-0.889768661871-0.221901319554-0.5198021500040.4827590823960.1352631037080.02550896396990.6174419391810.252450522535-0.02991885704940.674064839376-0.04958977868720.595860947096-20.171385593-17.677078287727.7916654453
381.316673817420.114934157201-0.2899650516936.17094259618-0.6343303772934.295119801550.1377446186450.493945653095-0.382453804477-1.51797636919-0.0984220668873-1.349352433610.8246958293340.8335239822920.02047793610250.8964616998660.3884224875220.1461314283160.856935830981-0.01646166496950.846592658435-14.266075885-22.953563396922.2351573745
392.952551727233.95317035412-1.359362983365.44720140622-1.184892597343.014013249320.3837028482890.182430901954-0.688343491582-0.281528045497-0.323901704394-1.055482814160.544872228523-0.0768005842479-0.08142997764160.8879659063250.417682056807-0.2023697316080.836757838612-0.04592467772060.989406957247-19.4102320431-35.086219405930.9139441438
402.262825982870.1671096520031.176476538813.08789938388-0.7292033371060.8089082480280.2237860273250.437267306333-0.581887373368-0.1457726236250.186425070276-0.5652865172520.4525592354360.405236266121-0.0874214603751.346068408390.548797058727-0.3688032951550.667817836168-0.1516713957821.33733243417-12.5436983539-39.068905587626.997980414
精密化 TLSグループ

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'A' and (resid -4 through 17 )AA-4 - 171 - 22
22chain 'A' and (resid 18 through 49 )AA18 - 4923 - 54
33chain 'A' and (resid 50 through 128 )AA50 - 12855 - 133
44chain 'A' and (resid 129 through 151 )AA129 - 151134 - 154
55chain 'A' and (resid 152 through 207 )AA152 - 207155 - 210
66chain 'A' and (resid 208 through 224 )AA208 - 224211 - 227
77chain 'B' and (resid 0 through 17 )BC0 - 171 - 18
88chain 'B' and (resid 18 through 109 )BC18 - 10919 - 110
99chain 'B' and (resid 110 through 134 )BC110 - 134111 - 135
1010chain 'B' and (resid 135 through 151 )BC135 - 151136 - 150
1111chain 'B' and (resid 152 through 207 )BC152 - 207151 - 206
1212chain 'B' and (resid 208 through 223 )BC208 - 223207 - 222
1313chain 'C' and (resid 1 through 27 )CE1 - 271 - 27
1414chain 'C' and (resid 28 through 84 )CE28 - 8428 - 84
1515chain 'C' and (resid 85 through 108 )CE85 - 10885 - 108
1616chain 'C' and (resid 109 through 129 )CE109 - 129109 - 129
1717chain 'C' and (resid 130 through 151 )CE130 - 151130 - 149
1818chain 'C' and (resid 152 through 207 )CE152 - 207150 - 205
1919chain 'C' and (resid 208 through 222 )CE208 - 222206 - 220
2020chain 'D' and (resid -1 through 17 )DG-1 - 171 - 19
2121chain 'D' and (resid 18 through 83 )DG18 - 8320 - 85
2222chain 'D' and (resid 84 through 128 )DG84 - 12886 - 130
2323chain 'D' and (resid 129 through 151 )DG129 - 151131 - 151
2424chain 'D' and (resid 152 through 207 )DG152 - 207152 - 207
2525chain 'D' and (resid 208 through 223 )DG208 - 223208 - 223
2626chain 'E' and (resid -1 through 17 )EI-1 - 171 - 19
2727chain 'E' and (resid 18 through 49 )EI18 - 4920 - 51
2828chain 'E' and (resid 50 through 83 )EI50 - 8352 - 85
2929chain 'E' and (resid 84 through 151 )EI84 - 15186 - 151
3030chain 'E' and (resid 152 through 191 )EI152 - 191152 - 191
3131chain 'E' and (resid 192 through 207 )EI192 - 207192 - 207
3232chain 'E' and (resid 208 through 223 )EI208 - 223208 - 223
3333chain 'F' and (resid 0 through 14 )FK0 - 141 - 15
3434chain 'F' and (resid 15 through 38 )FK15 - 3816 - 39
3535chain 'F' and (resid 39 through 98 )FK39 - 9840 - 99
3636chain 'F' and (resid 99 through 126 )FK99 - 126100 - 127
3737chain 'F' and (resid 127 through 151 )FK127 - 151128 - 150
3838chain 'F' and (resid 152 through 191 )FK152 - 191151 - 190
3939chain 'F' and (resid 192 through 207 )FK192 - 207191 - 206
4040chain 'F' and (resid 208 through 222 )FK208 - 222207 - 221

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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