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- PDB-3oug: Crystal structure of cleaved L-aspartate-alpha-decarboxylase from... -

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基本情報

登録情報
データベース: PDB / ID: 3oug
タイトルCrystal structure of cleaved L-aspartate-alpha-decarboxylase from Francisella tularensis
要素Aspartate 1-decarboxylase
キーワードLYASE / Structural Genomics / Center for Structural Genomics of Infectious Diseases / CSGID / double-psi beta barrel / Aspartic alpha-decarboxylase / L-aspartate 1-carboxy-lyase (beta-alanine-forming) / pantothenate biosynthesis
機能・相同性
機能・相同性情報


alanine biosynthetic process / aspartate 1-decarboxylase / aspartate 1-decarboxylase activity / pantothenate biosynthetic process / cytoplasm
類似検索 - 分子機能
Aspartate decarboxylase / Aspartate decarboxylase / Barwin-like endoglucanases - #20 / Barwin-like endoglucanases / Aspartate decarboxylase-like domain superfamily / Beta Barrel / Mainly Beta
類似検索 - ドメイン・相同性
Aspartate 1-decarboxylase
類似検索 - 構成要素
生物種Francisella tularensis subsp. tularensis (バクテリア)
手法X線回折 / シンクロトロン / SAD with molecular replacement / 解像度: 1.55 Å
データ登録者Nocek, B. / Gu, M. / Papazisi, L. / Anderson, W. / Joachimiak, A. / Center for Structural Genomics of Infectious Diseases (CSGID)
引用ジャーナル: To be Published
タイトル: Crystal structure of cleaved L-aspartate-alpha-decarboxylase from Francisella tularensis
著者: Nocek, B. / Gu, M. / Papazisi, L. / Anderson, W. / Joachimiak, A.
履歴
登録2010年9月14日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02010年10月20日Provider: repository / タイプ: Initial release
改定 1.12011年7月13日Group: Version format compliance
改定 1.22023年9月6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_ref_seq_dif / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_conn.pdbx_leaving_atom_flag / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id
改定 1.32023年12月6日Group: Data collection / カテゴリ: chem_comp_atom / chem_comp_bond / Item: _chem_comp_atom.atom_id / _chem_comp_bond.atom_id_2

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構造の表示

構造ビューア分子:
MolmilJmol/JSmol

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集合体

登録構造単位
A: Aspartate 1-decarboxylase
B: Aspartate 1-decarboxylase
C: Aspartate 1-decarboxylase
E: Aspartate 1-decarboxylase
F: Aspartate 1-decarboxylase
G: Aspartate 1-decarboxylase
H: Aspartate 1-decarboxylase
I: Aspartate 1-decarboxylase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)102,51022
ポリマ-101,6748
非ポリマー83614
16,051891
1
A: Aspartate 1-decarboxylase
B: Aspartate 1-decarboxylase
C: Aspartate 1-decarboxylase
E: Aspartate 1-decarboxylase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)51,16310
ポリマ-50,8374
非ポリマー3266
724
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area9560 Å2
ΔGint-84 kcal/mol
Surface area17650 Å2
手法PISA
2
F: Aspartate 1-decarboxylase
G: Aspartate 1-decarboxylase
H: Aspartate 1-decarboxylase
I: Aspartate 1-decarboxylase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)51,34712
ポリマ-50,8374
非ポリマー5108
724
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area10520 Å2
ΔGint-79 kcal/mol
Surface area17260 Å2
手法PISA
3


  • 登録構造と同一
  • 登録者が定義した集合体
タイプ名称対称操作
identity operation1_555x,y,z1
単位格子
Length a, b, c (Å)79.934, 80.525, 85.025
Angle α, β, γ (deg.)90.00, 104.33, 90.00
Int Tables number4
Space group name H-MP1211

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要素

#1: タンパク質
Aspartate 1-decarboxylase / Aspartate alpha-decarboxylase / Aspartate 1-decarboxylase beta chain / Aspartate 1-decarboxylase alpha chain


分子量: 12709.223 Da / 分子数: 8 / 由来タイプ: 組換発現
由来: (組換発現) Francisella tularensis subsp. tularensis (バクテリア)
: SCHU S4 / プラスミド: pMCSG7 / 発現宿主: Escherichia coli (大腸菌) / 株 (発現宿主): BL21 magic / 参照: UniProt: Q5NF56, aspartate 1-decarboxylase
#2: 化合物
ChemComp-CL / CHLORIDE ION / クロリド


分子量: 35.453 Da / 分子数: 8 / 由来タイプ: 合成 / : Cl
#3: 化合物
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL / グリセロ-ル


分子量: 92.094 Da / 分子数: 6 / 由来タイプ: 合成 / : C3H8O3
#4: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 891 / 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: 2.61 Å3/Da / 溶媒含有率: 52.83 %
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: 5.5
詳細: 0.2 M Lithium sulfate, 0.1 M Bis-Tris, 25% PeG 3350, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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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: 19-ID / 波長: 0.9794 Å
検出器タイプ: ADSC QUANTUM 315r / 検出器: CCD / 日付: 2009年10月9日 / 詳細: mirrors
放射モノクロメーター: double crystal / 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: 0.9794 Å / 相対比: 1
反射解像度: 1.55→40 Å / Num. all: 151160 / Num. obs: 150740 / % possible obs: 99.7 % / Observed criterion σ(F): 2 / Observed criterion σ(I): 2 / 冗長度: 3.7 % / Rmerge(I) obs: 0.071 / Net I/σ(I): 27.6
反射 シェル解像度: 1.55→1.58 Å / Rmerge(I) obs: 0.663 / % possible all: 99.7

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解析

ソフトウェア
名称バージョン分類
SBC-Collectデータ収集
Auto-Rickshaw位相決定
REFMAC5.5.0109精密化
HKL-3000データ削減
HKL-3000データスケーリング
精密化構造決定の手法: SAD with molecular replacement
開始モデル: 2C45
解像度: 1.55→28.66 Å / Cor.coef. Fo:Fc: 0.966 / Cor.coef. Fo:Fc free: 0.954 / SU B: 2.989 / SU ML: 0.049 / 交差検証法: THROUGHOUT / σ(F): 2 / σ(I): 2 / ESU R Free: 0.071 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor反射数%反射Selection details
Rfree0.19704 972 6 %RANDOM
Rwork0.17179 ---
all0.18 150301 --
obs0.17196 149429 99.44 %-
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: 1.4 Å / 溶媒モデル: MASK
原子変位パラメータBiso mean: 17.715 Å2
Baniso -1Baniso -2Baniso -3
1-0.02 Å20 Å2-0.02 Å2
2---0.08 Å20 Å2
3---0.05 Å2
精密化ステップサイクル: LAST / 解像度: 1.55→28.66 Å
タンパク質核酸リガンド溶媒全体
原子数6662 0 44 891 7597
拘束条件
Refine-IDタイプDev idealDev ideal target
X-RAY DIFFRACTIONr_bond_refined_d0.0140.0226972
X-RAY DIFFRACTIONr_bond_other_d0.0010.024742
X-RAY DIFFRACTIONr_angle_refined_deg1.511.9939460
X-RAY DIFFRACTIONr_angle_other_deg1.066311800
X-RAY DIFFRACTIONr_dihedral_angle_1_deg6.3285906
X-RAY DIFFRACTIONr_dihedral_angle_2_deg39.99726.138290
X-RAY DIFFRACTIONr_dihedral_angle_3_deg12.221151372
X-RAY DIFFRACTIONr_dihedral_angle_4_deg9.8721531
X-RAY DIFFRACTIONr_chiral_restr0.0950.21161
X-RAY DIFFRACTIONr_gen_planes_refined0.0060.0217513
X-RAY DIFFRACTIONr_gen_planes_other0.0010.021182
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_it1.0281.54351
X-RAY DIFFRACTIONr_mcbond_other0.1931.51743
X-RAY DIFFRACTIONr_mcangle_it1.9227141
X-RAY DIFFRACTIONr_scbond_it2.64632621
X-RAY DIFFRACTIONr_scangle_it4.5554.52284
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS精密化 シェル解像度: 1.55→1.59 Å / Total num. of bins used: 20
Rfactor反射数%反射
Rfree0.285 73 -
Rwork0.3 10626 -
obs--96.65 %
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)
10.20751.2353-0.65298.4214-1.76956.3812-0.0432-0.0102-0.0032-0.4673-0.02160.0316-0.20460.01080.06480.221-0.0212-0.04640.1804-0.04360.08642.88734.67263.1402
20.13690.04170.32971.59790.48891.11780.00430.0296-0.0917-0.13290.11-0.18480.00580.092-0.11430.1590.01180.02330.1293-0.03440.168256.347623.372420.7955
32.5783-1.18960.90111.8277-0.03233.47030.05170.2053-0.1169-0.26-0.0525-0.04230.09890.1870.00080.21560.03120.03510.1327-0.04980.101856.373320.006610.74
41.09660.2499-1.1720.9889-0.57952.91750.00360.0892-0.0943-0.17440.0074-0.05230.04850.0544-0.0110.16330.002-0.01440.1408-0.02670.143351.778428.010116.8184
53.4937-1.0639-2.10841.12270.11632.0820.08550.10870.0624-0.2305-0.0043-0.00190.00460.1075-0.08120.1665-0.0066-0.00740.1582-0.02410.105855.653330.011816.2112
61.1071-0.6527-1.437410.66244.30554.98270.07620.1471-0.1727-0.2768-0.0817-0.24640.18780.03270.00550.19130.0284-0.01390.1411-0.02310.153859.400516.36116.3443
72.41462.8502-0.31534.1531-0.38870.04640.00570.0617-0.0719-0.0735-0.0019-0.12750.0223-0.0102-0.00370.13730.0153-0.0010.1523-0.00570.13157.797227.925726.5264
82.11670.3514-0.25150.08150.387.9597-0.06310.1176-0.11050.00390.0027-0.01340.3181-0.11630.06040.2002-0.0115-0.02640.113-0.01990.157947.91623.97718.8136
91.3515-0.54270.91214.2416-0.82521.8394-0.19570.0869-0.2999-0.4877-0.0485-0.106-0.22440.1170.24420.234-0.00320.00180.16-0.02740.235743.005534.11840.392
105.1896-4.56075.86144.1935-6.145812.19320.04460.1804-0.3328-0.1355-0.06750.22750.3201-0.24380.02290.2934-0.074-0.05660.1256-0.08690.11442.007921.20477.3843
115.962-1.3745-0.80070.39180.79595.22550.09180.3245-0.0287-0.0932-0.04450.0089-0.37150.3764-0.04740.43440.0076-0.09920.1657-0.01340.02743.918947.70552.9108
121.6480.8283-0.96651.5512-1.41841.7604-0.00280.10620.1201-0.08540.03010.2582-0.0877-0.1273-0.02730.1380.0065-0.06510.1620.00050.16829.333141.905517.9574
132.6646-2.19662.06061.8841-1.44482.47260.32490.1655-0.3905-0.2585-0.11290.35130.28620.2102-0.2120.2033-0.0627-0.03330.1372-0.0440.246735.842824.150223.474
142.54280.527-1.47843.3136-1.79441.5892-0.04270.3038-0.0865-0.34810.03750.21010.1721-0.23890.00520.1763-0.0181-0.14250.1995-0.0910.187227.782935.12899.8414
150.4368-0.1499-0.47721.23561.32053.53220.00660.0645-0.0602-0.15090.00350.11210.0183-0.0552-0.01010.1499-0.0025-0.03290.14290.00820.142136.784238.166517.0321
162.22490.4885-0.621113.4537.11014.3153-0.02690.05950.01790.00220.1722-0.05710.06880.244-0.14530.18890.0407-0.0150.1982-0.02390.133842.063638.662720.0174
177.802-0.1645-0.69461.72620.36352.3135-0.01630.2703-0.301-0.32490.0280.27450.0804-0.298-0.01170.172-0.0373-0.07530.1383-0.00850.162327.503329.458713.6531
182.9587-1.89150.63251.3632-0.33740.16480.00840.0836-0.1064-0.09140.01120.0908-0.03440.0527-0.01960.1429-0.0239-0.01710.15090.00160.150137.167330.936124.6422
191.91781.0847-3.05651.5971-1.21815.907-0.02760.1360.0524-0.29090.0880.0952-0.1899-0.1619-0.06040.19820.0027-0.07110.1554-0.01650.134537.083443.811311.0767
204.59823.8503-5.77693.8341-3.399612.0460.06020.28850.3177-0.26360.03240.4962-0.6353-0.587-0.09270.21570.0937-0.17690.2691-0.02510.186829.05347.13718.6475
2128.3624-4.135810.65771.0588-2.45825.8013-0.08750.6859-0.3992-0.0945-0.0033-0.06580.15110.06480.09080.33540.00580.0570.1925-0.04770.042953.993733.23142.9363
221.44980.51810.83721.46531.01621.29720.01590.1966-0.0212-0.11840.0039-0.16380.00430.1002-0.01980.12740.00270.05280.18060.00140.137468.963840.602417.2643
230.21920.51950.24334.43943.30042.58510.29930.10120.0194-0.46340.2029-0.6863-0.60060.0182-0.50220.54870.13360.19930.06320.06480.445161.908257.28224.3126
241.12560.17821.25232.98441.68142.14530.04370.17360.0995-0.32020.0148-0.2783-0.14070.2055-0.05850.1486-0.00970.10220.23550.02290.132870.490646.345310.0928
250.6789-0.5060.6141.2715-1.57263.65430.03750.10980.058-0.1449-0.0106-0.1185-0.05460.0299-0.0270.1503-0.0010.03260.1551-0.01080.144461.968342.947116.93
260.9798-0.00590.49912.0155-0.56780.82120.02440.25140.1119-0.31170.0003-0.0462-0.02250.0815-0.02470.18220.0140.05360.18520.00990.101665.040248.534415.4721
2711.0822-2.0251-2.99984.41370.34851.11840.0888-0.10070.2697-0.06320.087-0.21640.0603-0.0093-0.17580.1334-0.0140.03660.16880.00910.145468.728950.155220.045
282.2487-2.0376-0.12512.3424-0.08710.09450.01610.00070.0433-0.06880.0161-0.04050.0251-0.0071-0.03220.1345-0.00210.00570.14040.0010.132961.880248.33327.3332
292.89190.41422.93420.81980.86355.62030.14190.2252-0.1726-0.30750.0124-0.15290.26060.0459-0.15440.23420.02450.05390.17360.00870.126859.879736.09897.2807
305.17673.58448.1394.783.369515.04540.07790.1552-0.2766-0.3901-0.0679-0.61840.52070.3691-0.00990.19340.10520.10170.3016-0.0460.1369.315434.16298.3008
310.862-1.0599-0.86611.9530.82021.88280.06620.14160.1417-0.3133-0.0805-0.05-0.0180.02210.01430.1928-0.0123-0.00980.16250.06570.110252.089654.825512.3616
325.92075.136-2.00746.7737-1.01550.9085-0.07530.51630.6997-0.38660.32060.5748-0.0685-0.222-0.24530.16580.0645-0.05460.2410.06130.212232.199752.685125.2799
331.398-0.0119-0.80311.9621-0.28612.3376-0.00890.10630.0488-0.25380.00340.0912-0.1206-0.01640.00550.20370.0071-0.05020.13190.03410.11643.322361.90410.6511
341.0480.12871.52381.08270.24013.1605-0.02250.05070.0448-0.21030.00650.0963-0.02510.01730.0160.1612-0.002-0.00150.12560.01210.13546.901653.409716.5005
359.0491-0.53336.35361.4545-0.15134.50330.1719-0.0315-0.1945-0.1744-0.0320.05350.1219-0.0118-0.13990.1807-0.0225-0.00820.17650.01180.102345.513148.410818.5935
360.11-0.7380.33947.0766-0.78793.40120.02820.01120.0064-0.2297-0.03690.4385-0.2236-0.0580.00860.16860.0254-0.02720.12780.05830.267938.699263.691215.0992
372.18852.9230.3354.13030.34590.1049-0.040.07340.0346-0.09090.0570.099-0.020.0139-0.0170.1380.0186-0.00990.15710.00140.138540.986853.099526.4581
380.4154-0.844-0.41471.8161.0335.31890.07260.09310.0724-0.2278-0.1047-0.06280.09860.18890.03210.2049-0.018-0.00020.18950.05080.134752.269652.383110.9358
396.626-9.023-7.961715.3311.35189.6520.2333-1.01540.9028-2.51061.0434-1.7399-0.75121.1802-1.27671.39930.0690.38580.5614-0.05420.213960.219449.8045-3.1223
404.557-4.8096-5.25365.39914.469216.5434-0.011700.6014-0.2380.0369-0.554-0.21690.5744-0.02520.3676-0.1042-0.13690.12210.15550.277755.052862.954311.8202
4115.08931.0981-5.64840.1127-0.87049.17580.0189-0.290.2430.02510.0149-0.0023-0.0977-0.427-0.03380.22320.0033-0.04730.144-0.00010.121355.607946.373560.6622
420.77-0.23020.22030.39970.33280.92650.0314-0.0267-0.10030.0605-0.0154-0.00810.0951-0.0386-0.01590.12010.0118-0.00030.13530.0050.149164.100330.27144.0923
434.2351-0.0331.64991.6657-0.00083.29530.048-0.0111-0.1730.07660.01080.08890.2007-0.1436-0.05890.12980.00610.00520.14010.00740.142564.53825.377848.2377
443.3479-1.5833-2.52824.55622.88053.8422-0.1138-0.16820.06960.15290.1618-0.26030.08490.1486-0.0480.1330.0111-0.0260.14490.00140.150470.07431.155755.8608
450.68220.5263-1.04511.6987-2.06824.19670.0024-0.0405-0.04690.0339-0.0109-0.03060.0263-0.00340.00850.11180.0004-0.00920.1338-0.0060.138960.460434.802246.0234
461.2978-0.87380.521311.8613-7.8015.1352-0.0479-0.03050.0580.13980.07110.0396-0.0837-0.028-0.02330.1263-0.0203-0.0070.1632-0.00710.140255.857133.998646.3655
476.6247-2.4924-0.25492.4316-0.02481.2792-0.0286-0.1332-0.21990.12310.0287-0.04490.07980.077-0.00010.13740.0084-0.01580.12150.00250.15269.553423.522149.595
484.20560.81750.47840.17540.0650.11260.0443-0.0565-0.03470.001700.0059-0.0158-0.0331-0.04440.13170.00820.00060.1345-0.0060.148559.523528.278838.2523
491.3331-1.044-2.15981.54321.54434.61180.0116-0.08750.11440.16330.0854-0.0649-0.07320.1237-0.0970.1367-0.0071-0.02310.14170.00780.155161.783240.690952.7567
502.8806-3.2804-4.80195.95125.119510.67640.0058-0.25510.19370.21740.0307-0.3389-0.16360.2947-0.03660.0882-0.0174-0.08550.1902-0.02770.149870.390141.77855.3225
5117.02270.19435.27630.27561.21138.4658-0.1137-0.4249-0.26360.14730.11560.04660.08760.3821-0.00190.22920.02170.03810.15470.00660.126143.321234.339260.6623
520.8362-0.46030.24332.1733-1.44131.4246-0.0078-0.0773-0.04910.02720.03540.11890.0031-0.0672-0.02760.10520.00710.01730.14250.00110.147230.56345.327846.2393
532.13381.7645-0.29221.9087-1.00741.34590.1302-0.01110.34940.2719-0.06780.3015-0.30460.0878-0.06240.15230.00770.020.1302-0.02850.255541.773460.531240.0482
541.1431-0.55130.41792.5668-1.16391.2337-0.0524-0.1182-0.06970.16590.05610.1947-0.0907-0.09-0.00370.13210.01090.01330.1417-0.00910.151230.265151.377953.2515
550.60620.30840.6951.14651.38653.2178-0.0074-0.06040.05580.0666-0.01930.0682-0.0162-0.00690.02670.11390.00020.01530.13230.0060.138837.633345.962147.1418
562.54432.26941.15499.51695.81663.61130.0375-0.0425-0.03250.00650.0587-0.1076-0.03310.0995-0.09630.126-0.04080.00270.18790.01810.141442.843243.937543.5012
576.4847-1.8080.86611.12-0.2960.65-0.0395-0.13790.15940.13030.0410.0585-0.0562-0.0401-0.00150.13840.01020.01910.127-0.00010.15831.234556.611550.0202
583.21460.7811-0.28980.1973-0.0340.2250.0475-0.05320.02870.0088-0.00990.00690.02470.0293-0.03770.12680.00730.00190.13560.00710.138439.313852.679838.7086
591.4036-1.06052.31891.5809-1.65244.83010.0234-0.073-0.15970.13820.07650.07310.0543-0.0984-0.09990.1273-0.00440.02950.14070.00350.161137.092540.159852.1444
603.0924-3.57264.87085.9158-5.07410.0598-0.0007-0.2851-0.0710.26110.06160.23660.1881-0.2917-0.0610.1029-0.0240.08950.19470.02110.134429.865438.17357.1915
610.51432.62130.867913.66195.84169.75680.0955-0.0238-0.090.3136-0.0779-0.3584-0.4661-0.0062-0.01760.1695-0.0116-0.02640.17870.05870.14355.63733.785660.3328
620.47640.09310.44491.1586-0.40981.1931-0.0089-0.05950.00710.03420.03610.1316-0.0234-0.0962-0.02720.115-0.01630.01210.12930.00580.148539.035525.565243.4423
632.30010.97231.02061.9864-0.13632.66540.0443-0.1371-0.13480.1323-0.0006-0.02190.0275-0.1146-0.04360.1232-0.01190.0160.13670.00360.144538.059321.86852.8232
641.5186-0.4365-1.89850.82791.07374.3018-0.0113-0.0339-0.03220.04770.00890.0501-0.0155-0.02490.00240.11760.0004-0.00470.12280.01130.1444.188229.041845.7339
656.87580.6827-5.13712.048-0.44583.84080.1635-0.08880.09110.0119-0.0919-0.0479-0.12020.0548-0.07160.12180.007-0.01030.15760.00310.138142.363733.228747.1199
661.60322.08260.12466.45850.41431.74990.0449-0.1045-0.07750.1126-0.0640.17120.0563-0.05060.01910.1003-0.01280.00090.14890.02010.162432.365619.199649.4313
670.2726-1.01950.13023.9086-0.65140.3981-0.01140.00250.00190.04550.0270.0341-0.0295-0.0051-0.01560.1199-0.0096-0.00180.1389-0.00060.158637.873929.390238.0121
681.54411.56942.39091.98022.65637.12380.0024-0.1344-0.04120.02970.0174-0.0873-0.01150.0682-0.01980.1230.00850.00270.14520.02410.14949.742928.01552.6656
693.718410.5728.020230.620121.363422.44140.7513-0.0471-0.49872.3131-0.0052-1.27250.54740.2994-0.74610.4807-0.0729-0.210.45250.40080.443857.387327.586467.2091
707.07013.58825.38953.04474.545311.75960.1518-0.0326-0.45270.2867-0.0018-0.2410.45840.1725-0.150.18180.0142-0.01440.06520.06210.188249.249117.164952.0607
711.04722.5498-1.49639.2101-3.08867.15170.0859-0.06610.19020.26040.0090.33960.3965-0.1052-0.09490.1518-0.00040.01010.17-0.02720.118743.30446.67660.3617
720.52320.0783-0.42031.1180.36750.9912-0.0031-0.0618-0.01460.02620.0249-0.11460.02330.0843-0.02190.1165-0.0153-0.00640.1287-0.00240.134559.856955.091943.6589
731.72880.8656-0.63551.1988-0.42461.97910.0468-0.09690.070.1156-0.01010.0052-0.02550.0736-0.03670.1263-0.0143-0.0130.1395-0.00340.138961.044757.924653.0956
741.6855-0.66151.95281.0205-1.27294.4555-0.0214-0.0220.02310.06220.0172-0.0259-0.00010.03020.00430.117-0.00170.00960.1175-0.00940.127654.299251.470445.0313
757.06860.64235.36721.66080.67394.09760.1251-0.0925-0.06650.0196-0.08090.06770.0907-0.0711-0.04430.12810.00510.010.1541-0.00310.132656.539447.388547.2387
761.07461.78420.58924.98340.45831.94240.0082-0.08990.06320.0637-0.0183-0.2064-0.08560.07470.01010.1054-0.01090.00560.1492-0.01450.152865.885260.696248.6621
770.9819-2.1219-0.00624.6275-0.00450.664-0.0395-0.03480.00050.03070.0504-0.04440.0121-0.0045-0.01090.1172-0.00870.00760.14790.00390.143460.827750.522137.4765
781.47961.2124-2.12851.1878-2.33177.00670.0166-0.1226-0.0124-0.032-0.00210.07740.05080.0153-0.01450.1249-0.00290.00180.1382-0.00640.145650.525753.445750.6187
7915.36712.6068-17.888687.2822-17.696120.94550.5329-0.7075-0.89664.381-1.42843.5286-0.75350.89270.89550.3534-0.19440.26450.4846-0.14560.344140.614850.249967.6675
806.23114.0553-6.82853.3894-4.642613.52060.0408-0.01840.31370.3478-0.05410.1623-0.3733-0.20840.01340.1934-0.00190.02250.0925-0.06970.150349.141662.49353.5453
精密化 TLSグループ
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A1 - 7
2X-RAY DIFFRACTION2A8 - 22
3X-RAY DIFFRACTION3A23 - 39
4X-RAY DIFFRACTION4A40 - 53
5X-RAY DIFFRACTION5A54 - 62
6X-RAY DIFFRACTION6A63 - 72
7X-RAY DIFFRACTION7A73 - 84
8X-RAY DIFFRACTION8A85 - 89
9X-RAY DIFFRACTION9A90 - 98
10X-RAY DIFFRACTION10A99 - 109
11X-RAY DIFFRACTION11B1 - 7
12X-RAY DIFFRACTION12B8 - 15
13X-RAY DIFFRACTION13B16 - 26
14X-RAY DIFFRACTION14B27 - 39
15X-RAY DIFFRACTION15B40 - 53
16X-RAY DIFFRACTION16B54 - 58
17X-RAY DIFFRACTION17B59 - 69
18X-RAY DIFFRACTION18B70 - 81
19X-RAY DIFFRACTION19B82 - 98
20X-RAY DIFFRACTION20B99 - 109
21X-RAY DIFFRACTION21C1 - 6
22X-RAY DIFFRACTION22C7 - 17
23X-RAY DIFFRACTION23C18 - 22
24X-RAY DIFFRACTION24C26 - 39
25X-RAY DIFFRACTION25C40 - 53
26X-RAY DIFFRACTION26C54 - 67
27X-RAY DIFFRACTION27C68 - 73
28X-RAY DIFFRACTION28C74 - 84
29X-RAY DIFFRACTION29C85 - 98
30X-RAY DIFFRACTION30C99 - 109
31X-RAY DIFFRACTION31E1 - 17
32X-RAY DIFFRACTION32E18 - 23
33X-RAY DIFFRACTION33E26 - 38
34X-RAY DIFFRACTION34E39 - 53
35X-RAY DIFFRACTION35E54 - 59
36X-RAY DIFFRACTION36E60 - 71
37X-RAY DIFFRACTION37E72 - 84
38X-RAY DIFFRACTION38E85 - 95
39X-RAY DIFFRACTION39E96 - 101
40X-RAY DIFFRACTION40E102 - 109
41X-RAY DIFFRACTION41F1 - 6
42X-RAY DIFFRACTION42F7 - 22
43X-RAY DIFFRACTION43F23 - 31
44X-RAY DIFFRACTION44F32 - 39
45X-RAY DIFFRACTION45F40 - 54
46X-RAY DIFFRACTION46F55 - 59
47X-RAY DIFFRACTION47F60 - 69
48X-RAY DIFFRACTION48F70 - 82
49X-RAY DIFFRACTION49F83 - 98
50X-RAY DIFFRACTION50F99 - 109
51X-RAY DIFFRACTION51G1 - 6
52X-RAY DIFFRACTION52G7 - 17
53X-RAY DIFFRACTION53G18 - 23
54X-RAY DIFFRACTION54G26 - 38
55X-RAY DIFFRACTION55G39 - 53
56X-RAY DIFFRACTION56G54 - 58
57X-RAY DIFFRACTION57G59 - 69
58X-RAY DIFFRACTION58G70 - 82
59X-RAY DIFFRACTION59G83 - 97
60X-RAY DIFFRACTION60G98 - 109
61X-RAY DIFFRACTION61H1 - 6
62X-RAY DIFFRACTION62H7 - 22
63X-RAY DIFFRACTION63H23 - 39
64X-RAY DIFFRACTION64H40 - 54
65X-RAY DIFFRACTION65H55 - 60
66X-RAY DIFFRACTION66H61 - 69
67X-RAY DIFFRACTION67H70 - 84
68X-RAY DIFFRACTION68H85 - 96
69X-RAY DIFFRACTION69H97 - 101
70X-RAY DIFFRACTION70H102 - 109
71X-RAY DIFFRACTION71I1 - 6
72X-RAY DIFFRACTION72I7 - 22
73X-RAY DIFFRACTION73I23 - 40
74X-RAY DIFFRACTION74I41 - 54
75X-RAY DIFFRACTION75I55 - 60
76X-RAY DIFFRACTION76I61 - 71
77X-RAY DIFFRACTION77I72 - 84
78X-RAY DIFFRACTION78I85 - 94
79X-RAY DIFFRACTION79I95 - 100
80X-RAY DIFFRACTION80I101 - 109

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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://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