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- PDB-2y7a: Crystal structure of unliganded GTB P156L -

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基本情報

登録情報
データベース: PDB / ID: 2y7a
タイトルCrystal structure of unliganded GTB P156L
要素ABO GLYCOSYLTRANSFERASE
キーワードTRANSFERASE / ABO BLOOD GROUP
機能・相同性
機能・相同性情報


fucosylgalactoside 3-alpha-galactosyltransferase / glycoprotein-fucosylgalactoside alpha-N-acetylgalactosaminyltransferase / glycoprotein-fucosylgalactoside alpha-N-acetylgalactosaminyltransferase activity / fucosylgalactoside 3-alpha-galactosyltransferase activity / ABO blood group biosynthesis / hexosyltransferase activity / : / Golgi cisterna membrane / protein glycosylation / antigen binding ...fucosylgalactoside 3-alpha-galactosyltransferase / glycoprotein-fucosylgalactoside alpha-N-acetylgalactosaminyltransferase / glycoprotein-fucosylgalactoside alpha-N-acetylgalactosaminyltransferase activity / fucosylgalactoside 3-alpha-galactosyltransferase activity / ABO blood group biosynthesis / hexosyltransferase activity / : / Golgi cisterna membrane / protein glycosylation / antigen binding / manganese ion binding / vesicle / carbohydrate metabolic process / Golgi membrane / nucleotide binding / Golgi apparatus / extracellular region / metal ion binding / membrane
類似検索 - 分子機能
Glycosyl transferase, family 6 / Glycosyltransferase family 6 / Spore Coat Polysaccharide Biosynthesis Protein SpsA; Chain A / Spore Coat Polysaccharide Biosynthesis Protein SpsA; Chain A / Nucleotide-diphospho-sugar transferases / Alpha-Beta Complex / Alpha Beta
類似検索 - ドメイン・相同性
: / URIDINE-5'-DIPHOSPHATE / Histo-blood group ABO system transferase / ABO glycosyltransferase
類似検索 - 構成要素
生物種HOMO SAPIENS (ヒト)
手法X線回折 / 分子置換 / 解像度: 2.06 Å
データ登録者Weadge, J. / Palcic, M.M. / Henriksen, A.
引用
ジャーナル: To be Published
タイトル: Structural and Biochemical Characterization of the Human Blood Group a and B Galactosyltransferases Possessing the Pro156Leu Mutation
著者: Weadge, J. / Palcic, M.M. / Henriksen, A.
#1: ジャーナル: J.Mol.Biol. / : 2010
タイトル: Cysteine-to-Serine Mutants Dramatically Reorder the Active Site of Human Abo(H) Blood Group B Glycosyltransferase without Affecting Activity: Structural Insights Into Cooperative Substrate Binding.
著者: Schuman, B. / Persson, M. / Landry, R.C. / Polakowski, R. / Weadge, J.T. / Seto, N.O.L. / Borisova, S.N. / Palcic, M.M. / Evans, S.V.
履歴
登録2011年1月31日登録サイト: PDBE / 処理サイト: PDBE
改定 1.02012年2月15日Provider: repository / タイプ: Initial release
改定 1.12012年10月3日Group: Derived calculations
改定 1.22017年7月12日Group: Data collection / カテゴリ: diffrn_source / Item: _diffrn_source.type
改定 1.32023年12月20日Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Other / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_database_status / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_database_status.status_code_sf / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _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_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_label_seq_id / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_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: ABO GLYCOSYLTRANSFERASE
B: ABO GLYCOSYLTRANSFERASE
C: ABO GLYCOSYLTRANSFERASE
D: ABO GLYCOSYLTRANSFERASE
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)139,1636
ポリマ-138,7044
非ポリマー4592
6,774376
1
A: ABO GLYCOSYLTRANSFERASE
B: ABO GLYCOSYLTRANSFERASE
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)69,8114
ポリマ-69,3522
非ポリマー4592
362
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area5670 Å2
ΔGint-38.1 kcal/mol
Surface area22880 Å2
手法PISA
2
C: ABO GLYCOSYLTRANSFERASE

D: ABO GLYCOSYLTRANSFERASE


分子量 (理論値)分子数
合計 (水以外)69,3522
ポリマ-69,3522
非ポリマー00
362
タイプ名称対称操作
identity operation1_555x,y,z1
crystal symmetry operation1_545x,y-1,z1
Buried area4630 Å2
ΔGint-25.1 kcal/mol
Surface area23030 Å2
手法PISA
3
D: ABO GLYCOSYLTRANSFERASE

C: ABO GLYCOSYLTRANSFERASE


分子量 (理論値)分子数
合計 (水以外)69,3522
ポリマ-69,3522
非ポリマー00
362
タイプ名称対称操作
identity operation1_555x,y,z1
crystal symmetry operation1_565x,y+1,z1
Buried area4630 Å2
ΔGint-25.1 kcal/mol
Surface area23030 Å2
手法PISA
単位格子
Length a, b, c (Å)63.730, 78.290, 143.740
Angle α, β, γ (deg.)90.00, 88.96, 90.00
Int Tables number4
Space group name H-MP1211

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要素

#1: タンパク質
ABO GLYCOSYLTRANSFERASE


分子量: 34676.098 Da / 分子数: 4 / 断片: RESIDUES 54-344 / 変異: YES / 由来タイプ: 組換発現 / 由来: (組換発現) HOMO SAPIENS (ヒト) / 発現宿主: ESCHERICHIA COLI (大腸菌) / 株 (発現宿主): BL21(DE3)
参照: UniProt: Q70V26, UniProt: P16442*PLUS, fucosylgalactoside 3-alpha-galactosyltransferase
#2: 化合物 ChemComp-MN / MANGANESE (II) ION


分子量: 54.938 Da / 分子数: 1 / 由来タイプ: 合成 / : Mn
#3: 化合物 ChemComp-UDP / URIDINE-5'-DIPHOSPHATE / UDP


タイプ: RNA linking / 分子量: 404.161 Da / 分子数: 1 / 由来タイプ: 合成 / : C9H14N2O12P2 / コメント: UDP*YM
#4: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 376 / 由来タイプ: 天然 / : H2O
構成要素の詳細ENGINEERED RESIDUE IN CHAIN A, PRO 146 TO LEU ENGINEERED RESIDUE IN CHAIN B, PRO 146 TO LEU ...ENGINEERED RESIDUE IN CHAIN A, PRO 146 TO LEU ENGINEERED RESIDUE IN CHAIN B, PRO 146 TO LEU ENGINEERED RESIDUE IN CHAIN C, PRO 146 TO LEU ENGINEERED RESIDUE IN CHAIN D, PRO 146 TO LEU
配列の詳細N-TERMINAL DISCREPANCIES ENGINEERED TO CONSTRUCT EXPRESSION PLASMID.

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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: 2.72 Å3/Da / 溶媒含有率: 54.8 % / 解説: NONE
結晶化pH: 7
詳細: 5 MM MOPS PH 7, 1 MM MNCL2, 1 MM DTT, 0.1 M AMSO4, 10% (W/V) PEG 3350.

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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: 回転陽極 / タイプ: RIGAKU RUH3R / 波長: 1.5418
検出器タイプ: RIGAKU IMAGE PLATE / 検出器: IMAGE PLATE / 詳細: MIRRORS
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: 1.5418 Å / 相対比: 1
Reflection twin
Crystal-IDIDOperatorDomain-IDFraction
11H, K, L10.55
11h,-k,-l20.45
反射解像度: 2.06→143.76 Å / Num. obs: 75523 / % possible obs: 93.2 % / Observed criterion σ(I): 0 / 冗長度: 2.5 % / Biso Wilson estimate: 29.955 Å2 / Rmerge(I) obs: 0.07 / Net I/σ(I): 12.6
反射 シェル解像度: 2.06→2.16 Å / 冗長度: 2.8 % / Rmerge(I) obs: 0.35 / Mean I/σ(I) obs: 2.6 / % possible all: 77.6

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解析

ソフトウェア
名称バージョン分類
REFMAC5.5.0109精密化
MOSFLMデータ削減
SCALAデータスケーリング
MOLREP位相決定
精密化構造決定の手法: 分子置換
開始モデル: PDB ENTRY 1ZIZ
解像度: 2.06→143.76 Å / Cor.coef. Fo:Fc: 0.935 / Cor.coef. Fo:Fc free: 0.92 / SU B: 9.629 / SU ML: 0.113 / 交差検証法: THROUGHOUT / ESU R: 0.049 / ESU R Free: 0.039 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD
詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. DISORDERED REGIONS AND SIDECHAINS WERE NOT MODELED.
Rfactor反射数%反射Selection details
Rfree0.24453 4047 5.1 %RANDOM
Rwork0.21567 ---
obs0.21716 75523 91 %-
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: BABINET MODEL WITH MASK
原子変位パラメータBiso mean: 39.362 Å2
Baniso -1Baniso -2Baniso -3
1-7.46 Å20 Å2-6.98 Å2
2---27.82 Å20 Å2
3---20.35 Å2
精密化ステップサイクル: LAST / 解像度: 2.06→143.76 Å
タンパク質核酸リガンド溶媒全体
原子数8969 0 26 376 9371
拘束条件
Refine-IDタイプDev idealDev ideal target
X-RAY DIFFRACTIONr_bond_refined_d0.0070.0229253
X-RAY DIFFRACTIONr_bond_other_d
X-RAY DIFFRACTIONr_angle_refined_deg0.9841.95212570
X-RAY DIFFRACTIONr_angle_other_deg
X-RAY DIFFRACTIONr_dihedral_angle_1_deg5.28951097
X-RAY DIFFRACTIONr_dihedral_angle_2_deg34.23522.648438
X-RAY DIFFRACTIONr_dihedral_angle_3_deg14.213151529
X-RAY DIFFRACTIONr_dihedral_angle_4_deg13.1041574
X-RAY DIFFRACTIONr_chiral_restr0.0710.21370
X-RAY DIFFRACTIONr_gen_planes_refined0.0040.0217063
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_it0.1641.55502
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it0.29528936
X-RAY DIFFRACTIONr_mcangle_other
X-RAY DIFFRACTIONr_scbond_it0.50433751
X-RAY DIFFRACTIONr_scbond_other
X-RAY DIFFRACTIONr_scangle_it0.794.53634
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
LS精密化 シェル解像度: 2.061→2.114 Å / Total num. of bins used: 20
Rfactor反射数%反射
Rfree0.3 174 -
Rwork0.297 2951 -
obs--48.82 %
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)
16.7791-6.80433.7399-2.59621.6671-0.76830.1026-0.4293-0.15460.45720.32-0.01650.2435-0.1271-0.42260.3232-0.08510.07140.3144-0.04870.3065-5.59831.062-9.991
26.18481.58864.92530.21222.11436.71-0.06650.38940.1572-0.22730.0471-0.1768-0.04980.15130.01940.29940.0070.15660.36010.01520.2283-8.49629.942-26.816
31.9991.10970.92531.83250.63480.07580.04340.13530.0265-0.15410.0138-0.0755-0.01320.0727-0.05720.13050.0310.08050.27340.00750.0995-9.18717.278-23.24
40.2027-18.7594-4.238329.3121-17.933619.2946-0.0824-0.60440.06180.52820.1033-0.4394-0.47450.0775-0.0210.2084-0.0620.06860.3563-0.04570.2278-1.7323.793-7.556
53.43210.98860.69861.47940.76241.79340.15760.0872-0.4311-0.0229-0.1249-0.20920.30270.1137-0.03270.1442-0.0050.04240.2935-0.03290.14035.586-1.628-9.783
63.0058-0.75692.60014.7107-0.56891.56260.24240.29-0.0514-0.3613-0.0712-0.44260.03370.2869-0.17120.1379-0.00520.11870.3774-0.08910.22479.4149.251-14.674
73.3398-0.50553.52948.2496-13.222810.48220.0743-0.0170.01310.3793-0.2172-0.0488-0.4736-0.06090.14290.0963-0.01320.07910.29990.00490.11715.78.419-4.609
81.6727-0.39510.80346.60050.49931.19790.11250.0183-0.1165-0.0243-0.0452-0.56760.10870.1908-0.06730.16250.01570.06650.35710.0120.212112.3152.671-5.162
9-5.9628-1.0607-9.1167-0.4422-4.35412.1371-0.02370.37590.1075-0.2857-0.04080.14430.65150.21070.06450.40140.07010.02710.49520.00160.37871.503-8.334-2.108
102.48652.31822.8786.51523.85486.84940.21-0.2213-0.14160.3338-0.0645-0.15190.5005-0.2386-0.14550.11640.02850.06030.30850.02140.1293-4.16-2.799-0.93
113.90240.4418-2.979510.33440.43929.4715-0.0663-0.70320.0150.5118-0.0961-0.06440.08190.2580.16240.1248-0.02540.04610.2877-0.00530.0972-1.4458.4141.631
120.4168-0.6316-0.2356.9619-1.03083.3347-0.00760.0411-0.09160.07980.0626-0.13960.34090.1251-0.0550.0955-0.01420.0660.2988-0.06090.16280.9963.092-13.363
132.88050.72342.31760.1397-0.891.8208-0.0219-0.0068-0.0766-0.0842-0.0543-0.1233-0.08920.15360.07610.1404-0.00840.08780.2317-0.00590.09890.54112.4-18.028
142.0771-1.6077-2.3419-0.14090.19794.12180.0796-0.0140.0273-0.18170.07780.0231-0.12380.2986-0.15740.148-0.04340.06610.2982-0.00020.1028-10.1862.713-23.001
151.5830.6015-0.17932.36790.15860.9669-0.08450.0901-0.1916-0.25410.09420.04450.1408-0.0517-0.00970.10770.00460.0530.2549-0.01230.0906-16.725-3.648-18.37
164.56838.9782.149514.80464.32911.08710.1679-0.16720.07080.3458-0.17660.2380.1117-0.02450.00870.07970.02770.09490.30090.01130.1098-13.243-2.225-4.034
171.1895-0.3446-1.754111.0671-5.338317.0974-0.0574-0.0920.0068-0.3753-0.214-0.5405-0.1080.85430.27140.0985-0.02490.07750.3402-0.02060.1626-16.473-16.505-7.938
182.4558-1.1502-1.19096.18941.85153.1254-0.0006-0.0344-0.09740.09820.01190.0080.22720.0485-0.01140.12050.00040.02780.2636-0.00420.0767-14.288-5.057-14.858
191.2411-0.9925-0.3630.7339-0.53421.4965-0.03130.1759-0.1094-0.0265-0.04570.0150.0866-0.0460.0770.097-0.02040.02970.2534-0.06290.0744-7.1566.397-21.466
203.49112.0882-1.21421.19062.54143.6863-0.0720.1513-0.07840.0420.211-0.22960.29780.1038-0.1390.25240.02590.07830.3672-0.04810.07361.4524.811-29.084
216.6422-1.95830.15530.17011.6170.20640.01140.02880.10530.0333-0.04140.1916-0.0934-0.10770.03010.2761-0.00620.0580.26370.00850.2807-27.132.644-19.569
2223.89310.1131-5.99217.3510.999220.4693-0.37130.8757-0.4872-0.3592-0.24720.20060.243-0.4220.61850.3370.02460.11720.3237-0.05220.1255-16.4838.506-31.307
2319.024621.7538.9914-3.79583.480925.1138-0.08751.488-1.7566-0.13530.7983-0.75461.32561.3706-0.71080.47280.03340.15010.4953-0.05210.1897-19.03120.91-33.19
242.20050.0865-0.1452.21110.28920.50390.03280.0916-0.2379-0.1848-0.0425-0.0824-0.02-0.070.00970.08580.02410.0390.25380.00010.0471-21.09818.962-21.687
252.6686-3.1414-1.27513.04322.11761.3566-0.1282-0.2189-0.37510.27460.07740.36270.32550.11710.05080.1520.02510.05520.31550.0470.136-30.68518.896-7.889
266.94430.01622.77332.34422.19225.14340.03820.02361.0844-0.7337-0.24620.286-0.8643-0.26130.20810.35880.01980.0830.33470.01540.2935-39.7642.254-11.813
271.99620.2974-0.27834.24921.86143.0040.0784-0.03480.10410.0564-0.10740.18920.0247-0.19040.0290.0501-0.00040.08330.29590.01270.1089-39.3329.924-10.108
284.12720.88830.94186.6211.37162.33380.2413-0.08060.258-0.0641-0.20710.4906-0.1036-0.2948-0.03420.0990.00060.11690.3298-0.0130.1569-43.0330.528-5
293.18450.81310.30265.7752-1.67042.0098-0.0752-0.14590.33910.47730.0529-0.1077-0.49020.01120.02220.18120.01020.06920.2949-0.03780.1693-25.97842.74-2.976
300.9249-0.66591.11991.21640.7824.5508-0.0266-0.17620.17850.44010.1188-0.03270.07690.0472-0.09220.1815-0.01880.06070.31050.02250.138-29.15127.385-0.849
311.72481.72461.60285.93284.93058.8853-0.05110.22370.0871-0.39190.13220.3825-0.41930.1235-0.08110.09260.01890.04890.26690.04240.1081-34.8131.484-19.113
321.76530.4738-0.93821.67560.83660.62550.0261-0.0240.16180.00230.0605-0.0176-0.03190.045-0.08660.11070.02410.05810.24840.01180.0422-22.91328.879-18.146
332.42070.88790.34183.19021.49922.9326-0.05510.20120.2226-0.42890.1665-0.3555-0.46090.3587-0.11140.159-0.02950.09190.26340.03130.1202-11.26343.772-20.268
345.75831.1843-0.62911.4133-0.02131.36050.02420.04530.1888-0.13920.06130.0081-0.18140.0692-0.08550.11470.01790.06580.21610.00170.0781-15.29736.98-18.774
353.25545.9038-1.121915.7269-0.71554.79580.2914-0.6204-0.14770.5037-0.3152-0.39240.20450.22690.02380.0735-0.00640.01920.27270.00840.0776-19.51131.578-3.325
366.35654.9323-1.53784.5232-2.1236-2.14870.2481-0.28840.41110.3331-0.14550.5268-0.0724-0.1201-0.10260.20390.00960.07770.3713-0.01360.1586-16.11946.241-3.408
373.67450.7340.02534.58931.06232.38890.0666-0.03530.1947-0.069-0.15330.1626-0.0971-0.13290.08670.09810.01060.06380.25360.02940.0794-16.63745.341-12.065
382.16160.37610.77081.24480.43711.0612-0.07470.1502-0.04270.01510.07620.0268-0.1716-0.0097-0.00150.0966-0.01390.05610.20850.02010.0642-18.329.59-17.666
3914.6509-0.17174.305116.6742-17.540211.7135-0.1982-0.60670.07340.61430.02230.302-0.8794-0.12490.17580.40110.0002-0.0690.33050.02080.1233-31.01738.115-30.059
401.38252.01790.89380.1106-0.2649.46050.0485-0.05930.0294-0.2321-0.00020.1209-0.05950.0508-0.04830.2472-0.04160.04090.29810.06330.1146-31.530.398-28.752
41-0.49370.60770.28980.1219-0.24150.2949-0.0075-0.0511-0.0416-0.0382-0.0246-0.2676-0.0640.15520.0320.28180.00520.07170.4347-0.01660.3573-7.773-30.894-45.359
423.38370.72870.06033.62660.41781.1527-0.24260.1173-0.1849-0.26870.2179-0.16030.04090.11880.02470.1987-0.0440.08970.29350.00490.1032-9.045-19.385-48.865
43-2.618112.28085.02327.1267-3.18722.31140.36660.3185-0.1577-1.5148-0.10960.14150.44320.6006-0.25690.4211-0.05540.23520.5072-0.10470.4537-0.773-22.756-64.634
444.8431.1363.4655.2941-0.41152.753-0.05040.49510.4350.3013-0.1292-0.0967-0.35660.28550.17960.4123-0.11020.16650.4706-0.04360.25997.6461.558-59.037
451.02122.64213.967510.62512.66995.8311-0.1293-0.00190.05080.11080.1669-0.2782-0.00540.1718-0.03750.2109-0.06520.15870.4923-0.09040.19659.267-12.512-55.671
464.821-2.6555-0.2509-2.5389-0.94454.12010.1333-0.17590.3387-0.5951-0.14160.02410.12420.01770.00830.3747-0.02370.18050.4711-0.07020.21697.276-4.801-65.974
475.3638-1.39030.282115.2427-2.52512.83540.2154-0.1290.16670.6682-0.1077-0.1333-0.15480.2772-0.10770.3108-0.03070.13660.448-0.0240.145611.786-6.863-66.259
4813.2937-2.0164-1.004322.759214.517113.11330.13860.1347-0.0315-0.07410.1308-0.57150.0364-0.0017-0.26940.2959-0.04740.04990.41590.0430.2139-5.144-0.127-69.721
491.8839-0.0097-0.50771.095-1.26642.20310.00640.09770.0085-0.12210.109-0.0121-0.102-0.0426-0.11550.3504-0.05990.03870.3993-0.01570.2487-0.122-7.074-64.652
506.9957-0.01040.873-1.6307-0.76068.0415-0.23890.0503-0.5171-0.10350.1678-0.6655-0.4633-0.01350.07110.3901-0.08070.17760.3664-0.11530.35283.047-13.796-50.736
511.0295-1.0611.4548-4.5661-3.4787-4.26210.17990.3143-0.0685-0.2088-0.06910.31660.0172-0.1427-0.11070.4159-0.14290.08840.3935-0.00350.2279-8.609-9.978-54.99
5219.15765.965-6.241618.795410.8195.4754-0.6433-0.76690.1001-0.92310.73280.2759-0.16850.7115-0.08950.3402-0.00030.03150.33580.02220.2993-10.063-1.477-41.966
531.17740.0839-1.19030.9374-0.53840.2042-0.0218-0.019-0.31890.3562-0.1414-0.2548-0.3011-0.20920.16320.45550.03430.04560.40790.01890.508-20.6716.662-50.281
5416.06725.0822-1.618-1.94873.82864.95940.2291-0.45121.50520.1196-0.38930.5324-0.2767-0.1470.16030.307-0.07040.08060.35420.01910.5557-19.511-1.553-48.548
551.9323-1.592-3.44430.8-0.3595-1.98360.20830.1863-0.0524-0.3583-0.1686-0.0927-0.0616-0.2874-0.03970.3382-0.07950.02030.42290.00280.2409-10.288-4.149-62.979
5611.241-0.6971.85165.0551-8.15833.3213-0.7495-0.1444-0.24180.52210.298-0.1465-0.09080.28410.45160.3940.09650.03310.4158-0.06710.261-15.8639.545-66.069
572.3324-2.47911.8646-0.4143-1.27263.9726-0.0090.10270.28710.0470.0339-0.1637-0.25820.0706-0.02490.3358-0.0856-0.04560.3550.01750.325-13.219.502-57.658
58-16.97611.5164.15538.7028-8.9174-1.89710.85520.5357-0.53540.4385-0.7445-0.0003-0.3483-0.8579-0.11070.5322-0.0659-0.02430.57910.22720.4624-19.613-2.71-58.357
592.95740.66462.41211.63011.89095.017-0.4730.3971-0.1437-0.23570.6264-0.1076-0.33650.6122-0.15340.3459-0.09340.07980.3559-0.00630.0965-4.761-6.679-46.622
601.3459-0.71621.43324.1972-0.48347.0968-0.13680.2379-0.33360.07120.18-0.7087-0.35770.0764-0.04320.2209-0.01630.06370.3029-0.08860.17381.44-8.362-42.392
614.9037-3.35243.81181.6962-6.456-1.0508-0.0836-0.0417-0.03590.0788-0.1280.4575-0.1743-0.2290.21160.42930.02630.04340.3607-0.02480.4179-27.97273.584-53.484
623.42294.08640.75476.15671.1155-1.09420.1951-0.3122-0.0480.2466-0.2152-0.4172-0.0128-0.2230.02010.3322-0.00660.10860.5334-0.00950.33-19.08165.115-39.786
635.64252.1658-2.88026.1712-0.06581.9965-0.1991-0.1312-0.1546-0.10130.14040.0676-0.09640.09560.05870.2023-0.0410.03710.3165-0.01440.0595-17.85753.465-46.295
64-1.85216.15654.391917.337310.43696.98740.3685-0.0261-0.11470.7247-0.3789-0.42240.2102-0.33440.01050.3658-0.06960.00620.35160.11340.4209-28.93264.449-53.413
651.7279-4.54561.86769.6012-11.17824.5880.0067-0.36420.7437-0.6801-0.1395-0.18350.1585-0.30820.13290.52610.03220.02520.47730.03430.203-31.18856.408-62.984
66-4.45588.08793.17874.57822.5417.79940.0812-0.0261-0.49670.2111-0.0197-0.40690.57130.7635-0.06150.4341-0.06060.12990.5180.12240.5598-39.97833.9-58.577
678.761-1.04182.9159-3.6039-3.24566.76620.12110.50520.5019-0.0137-0.41770.35770.1874-0.36740.29660.4161-0.11350.02490.42490.05360.3011-41.28947.422-54.136
683.14741.7723-0.40463.59792.54098.72940.01920.0082-0.0307-0.1092-0.13920.0417-0.0613-0.20310.120.2965-0.00990.01080.35430.10830.2094-36.35252.264-61.917
693.6167-2.7156-0.7849.10811.85373.4209-0.17760.034-0.30970.25250.13970.45660.4486-0.22850.0380.3377-0.01440.07160.45010.03220.2808-43.77742.925-64.348
704.7841-4.36972.48355.9185-3.0930.65210.24840.4118-0.5203-0.1415-0.2553-0.14150.01520.14430.00690.5350.03110.07940.4912-0.07130.4106-30.9130.525-66.533
711.53942.341-6.662518.4975-6.65419.66050.25370.34970.083-0.78570.02350.009-0.12740.9696-0.27730.52410.13940.00750.7526-0.20610.1857-26.70837.386-69.954
721.01655.48457.7693-5.65273.645324.63440.17741.0411-0.838-0.4243-0.50030.0709-0.00372.2190.32290.5387-0.09950.03210.78330.03190.3417-29.07743.551-74.003
730.554-0.1474-1.18370.6439-0.32043.25410.00910.0837-0.0298-0.17660.04960.01450.0744-0.1523-0.05870.3348-0.09620.02030.41090.07750.289-32.1646.8-57.956
741.60091.5074-0.63090.6165-0.40060.4639-0.21780.13120.199-0.12870.26530.0780.08650.0555-0.04750.2674-0.04430.06130.34910.00610.1251-22.28945.883-51.028
752.2069-2.13880.3111.33170.22712.8883-0.043-0.1661-0.20710.26110.0944-0.16530.3860.3698-0.05130.357-0.01320.14050.4558-0.06660.4893-10.62830.892-51.225
762.2261-1.96631.5434.8882-3.07471.7597-0.04220.3172-0.3364-0.14370.0114-0.40290.14020.06970.03080.3224-0.09650.10910.399-0.10280.2788-15.27938.562-51.379
770.295-4.6206-0.462412.65933.37810.81980.28120.11720.2523-0.4973-0.2553-0.57370.06120.1384-0.02590.3528-0.05220.13960.52170.02130.3343-19.15641.949-67.156
782.219-3.2187-3.98125.68984.12755.8183-0.0601-0.06250.3242-0.01340.24290.43260.8754-0.052-0.18280.4928-0.03890.03980.4043-0.08770.3242-16.48525.702-61.607
792.59690.58490.00251.15180.21032.3588-0.28120.3585-0.3419-0.28220.202-0.26560.09640.11970.07920.2318-0.0470.10410.29170.04170.157-19.54542.023-52.904
803.8516-2.0987-0.03551.1747-3.54344.78-0.2131-0.17410.0378-0.08220.22860.30260.2830.0005-0.01550.2924-0.03080.04630.35730.06750.1534-31.44343.81-41.445
精密化 TLSグループ
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A62 - 68
2X-RAY DIFFRACTION2A69 - 80
3X-RAY DIFFRACTION3A81 - 107
4X-RAY DIFFRACTION4A108 - 113
5X-RAY DIFFRACTION5A114 - 130
6X-RAY DIFFRACTION6A131 - 145
7X-RAY DIFFRACTION7A146 - 151
8X-RAY DIFFRACTION8A152 - 172
9X-RAY DIFFRACTION9A173 - 186
10X-RAY DIFFRACTION10A187 - 198
11X-RAY DIFFRACTION11A199 - 205
12X-RAY DIFFRACTION12A206 - 215
13X-RAY DIFFRACTION13A216 - 226
14X-RAY DIFFRACTION14A227 - 240
15X-RAY DIFFRACTION15A241 - 275
16X-RAY DIFFRACTION16A276 - 289
17X-RAY DIFFRACTION17A290 - 297
18X-RAY DIFFRACTION18A298 - 312
19X-RAY DIFFRACTION19A313 - 327
20X-RAY DIFFRACTION20A328 - 345
21X-RAY DIFFRACTION21B65 - 73
22X-RAY DIFFRACTION22B74 - 79
23X-RAY DIFFRACTION23B80 - 84
24X-RAY DIFFRACTION24B85 - 107
25X-RAY DIFFRACTION25B108 - 120
26X-RAY DIFFRACTION26B121 - 131
27X-RAY DIFFRACTION27B132 - 158
28X-RAY DIFFRACTION28B159 - 175
29X-RAY DIFFRACTION29B181 - 197
30X-RAY DIFFRACTION30B198 - 208
31X-RAY DIFFRACTION31B209 - 220
32X-RAY DIFFRACTION32B221 - 236
33X-RAY DIFFRACTION33B237 - 255
34X-RAY DIFFRACTION34B256 - 271
35X-RAY DIFFRACTION35B272 - 283
36X-RAY DIFFRACTION36B284 - 292
37X-RAY DIFFRACTION37B293 - 309
38X-RAY DIFFRACTION38B310 - 324
39X-RAY DIFFRACTION39B325 - 330
40X-RAY DIFFRACTION40B331 - 345
41X-RAY DIFFRACTION41C66 - 82
42X-RAY DIFFRACTION42C83 - 108
43X-RAY DIFFRACTION43C109 - 116
44X-RAY DIFFRACTION44C117 - 133
45X-RAY DIFFRACTION45C134 - 144
46X-RAY DIFFRACTION46C145 - 158
47X-RAY DIFFRACTION47C159 - 175
48X-RAY DIFFRACTION48C188 - 197
49X-RAY DIFFRACTION49C198 - 215
50X-RAY DIFFRACTION50C216 - 223
51X-RAY DIFFRACTION51C224 - 233
52X-RAY DIFFRACTION52C234 - 239
53X-RAY DIFFRACTION53C240 - 258
54X-RAY DIFFRACTION54C259 - 264
55X-RAY DIFFRACTION55C265 - 285
56X-RAY DIFFRACTION56C286 - 291
57X-RAY DIFFRACTION57C292 - 307
58X-RAY DIFFRACTION58C308 - 313
59X-RAY DIFFRACTION59C314 - 331
60X-RAY DIFFRACTION60C332 - 345
61X-RAY DIFFRACTION61D65 - 71
62X-RAY DIFFRACTION62D72 - 82
63X-RAY DIFFRACTION63D83 - 100
64X-RAY DIFFRACTION64D101 - 108
65X-RAY DIFFRACTION65D109 - 120
66X-RAY DIFFRACTION66D121 - 132
67X-RAY DIFFRACTION67D133 - 140
68X-RAY DIFFRACTION68D141 - 150
69X-RAY DIFFRACTION69D151 - 169
70X-RAY DIFFRACTION70D170 - 188
71X-RAY DIFFRACTION71D189 - 195
72X-RAY DIFFRACTION72D196 - 200
73X-RAY DIFFRACTION73D201 - 221
74X-RAY DIFFRACTION74D222 - 238
75X-RAY DIFFRACTION75D239 - 255
76X-RAY DIFFRACTION76D256 - 270
77X-RAY DIFFRACTION77D271 - 287
78X-RAY DIFFRACTION78D288 - 301
79X-RAY DIFFRACTION79D302 - 327
80X-RAY DIFFRACTION80D328 - 345

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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