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- PDB-6pxa: The crystal structure of chloramphenicol acetyltransferase-like p... -

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データを開く


IDまたはキーワード:

読み込み中...

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基本情報

登録情報
データベース: PDB / ID: 6pxa
タイトルThe crystal structure of chloramphenicol acetyltransferase-like protein from Vibrio fischeri ES114 in complex with taurocholic acid
要素Chloramphenicol acetyltransferase
キーワードTRANSFERASE / Structural Genomics / Center for Structural Genomics of Infectious Diseases / CSGID
機能・相同性
機能・相同性情報


chloramphenicol O-acetyltransferase activity / chloramphenicol O-acetyltransferase / response to antibiotic / metal ion binding
類似検索 - 分子機能
: / Hexapeptide transferase, conserved site / Hexapeptide-repeat containing-transferases signature. / Hexapeptide repeat proteins / Hexapeptide repeat / UDP N-Acetylglucosamine Acyltransferase; domain 1 / Bacterial transferase hexapeptide (six repeats) / Trimeric LpxA-like superfamily / 3 Solenoid / Mainly Beta
類似検索 - ドメイン・相同性
ACETATE ION / FORMIC ACID / TAUROCHOLIC ACID / Chloramphenicol acetyltransferase
類似検索 - 構成要素
生物種Aliivibrio fischeri (バクテリア)
手法X線回折 / シンクロトロン / 分子置換 / 解像度: 1.82 Å
データ登録者Tan, K. / Maltseva, N. / Jedrzejczak, R. / Kuhn, M. / Joachimiak, A. / Center for Structural Genomics of Infectious Diseases (CSGID)
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)HHSN272201700060C 米国
引用ジャーナル: Microbiol Resour Announc / : 2025
タイトル: Structural genomics of bacterial drug targets: Application of a high-throughput pipeline to solve 58 protein structures from pathogenic and related bacteria.
著者: Inniss, N.L. / Minasov, G. / Chang, C. / Tan, K. / Kim, Y. / Maltseva, N. / Stogios, P. / Filippova, E. / Michalska, K. / Osipiuk, J. / Jaroszewki, L. / Godzik, A. / Savchenko, A. / ...著者: Inniss, N.L. / Minasov, G. / Chang, C. / Tan, K. / Kim, Y. / Maltseva, N. / Stogios, P. / Filippova, E. / Michalska, K. / Osipiuk, J. / Jaroszewki, L. / Godzik, A. / Savchenko, A. / Joachimiak, A. / Anderson, W.F. / Satchell, K.J.F.
履歴
登録2019年7月25日登録サイト: RCSB / 処理サイト: RCSB
改定 1.02019年9月25日Provider: repository / タイプ: Initial release
改定 1.12019年12月18日Group: Author supporting evidence / カテゴリ: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
改定 1.22023年10月11日Group: Data collection / Database references / Refinement description
カテゴリ: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession
改定 1.32025年6月18日Group: Database references / Structure summary
カテゴリ: citation / citation_author / pdbx_entry_details
Item: _citation.journal_abbrev / _citation.journal_id_CSD ..._citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _pdbx_entry_details.has_protein_modification

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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: Chloramphenicol acetyltransferase
B: Chloramphenicol acetyltransferase
C: Chloramphenicol acetyltransferase
D: Chloramphenicol acetyltransferase
E: Chloramphenicol acetyltransferase
F: Chloramphenicol acetyltransferase
G: Chloramphenicol acetyltransferase
H: Chloramphenicol acetyltransferase
I: Chloramphenicol acetyltransferase
J: Chloramphenicol acetyltransferase
K: Chloramphenicol acetyltransferase
L: Chloramphenicol acetyltransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)305,23561
ポリマ-296,95112
非ポリマー8,28449
13,980776
1
A: Chloramphenicol acetyltransferase
B: Chloramphenicol acetyltransferase
C: Chloramphenicol acetyltransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)76,29014
ポリマ-74,2383
非ポリマー2,05211
543
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area14630 Å2
ΔGint-122 kcal/mol
Surface area26880 Å2
手法PISA
2
D: Chloramphenicol acetyltransferase
E: Chloramphenicol acetyltransferase
F: Chloramphenicol acetyltransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)76,20313
ポリマ-74,2383
非ポリマー1,96510
543
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area14100 Å2
ΔGint-98 kcal/mol
Surface area26760 Å2
手法PISA
3
G: Chloramphenicol acetyltransferase
H: Chloramphenicol acetyltransferase
I: Chloramphenicol acetyltransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)76,26614
ポリマ-74,2383
非ポリマー2,02811
543
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area14600 Å2
ΔGint-128 kcal/mol
Surface area27040 Å2
手法PISA
4
J: Chloramphenicol acetyltransferase
K: Chloramphenicol acetyltransferase
L: Chloramphenicol acetyltransferase
ヘテロ分子


分子量 (理論値)分子数
合計 (水以外)76,47620
ポリマ-74,2383
非ポリマー2,23917
543
タイプ名称対称操作
identity operation1_555x,y,z1
Buried area15410 Å2
ΔGint-157 kcal/mol
Surface area26560 Å2
手法PISA
単位格子
Length a, b, c (Å)43.519, 121.363, 146.170
Angle α, β, γ (deg.)89.399, 89.911, 87.602
Int Tables number1
Space group name H-MP1
Space group name HallP1
Symmetry operation#1: x,y,z

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要素

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タンパク質 , 1種, 12分子 ABCDEFGHIJKL

#1: タンパク質
Chloramphenicol acetyltransferase


分子量: 24745.918 Da / 分子数: 12 / 由来タイプ: 組換発現
由来: (組換発現) Aliivibrio fischeri (strain ATCC 700601 / ES114) (バクテリア)
: ATCC 700601 / ES114 / 遺伝子: VF_A0790 / プラスミド: pMCSG53 / 発現宿主: Escherichia coli BL21(DE3) (大腸菌) / 株 (発現宿主): BL21(DE3) / Variant (発現宿主): -Magic
参照: UniProt: Q5DZD6, chloramphenicol O-acetyltransferase

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非ポリマー , 7種, 825分子

#2: 化合物
ChemComp-TCH / TAUROCHOLIC ACID / タウロコ-ル酸


分子量: 515.703 Da / 分子数: 12 / 由来タイプ: 合成 / : C26H45NO7S / タイプ: SUBJECT OF INVESTIGATION
#3: 化合物
ChemComp-CL / CHLORIDE ION / クロリド


分子量: 35.453 Da / 分子数: 16 / 由来タイプ: 合成 / : Cl
#4: 化合物
ChemComp-SO4 / SULFATE ION / 硫酸ジアニオン


分子量: 96.063 Da / 分子数: 4 / 由来タイプ: 天然 / : SO4
#5: 化合物 ChemComp-ACT / ACETATE ION / 酢酸イオン


分子量: 59.044 Da / 分子数: 3 / 由来タイプ: 合成 / : C2H3O2
#6: 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: 7 / 由来タイプ: 合成 / : C3H8O3
#7: 化合物
ChemComp-FMT / FORMIC ACID / ギ酸


分子量: 46.025 Da / 分子数: 7 / 由来タイプ: 合成 / : CH2O2
#8: 水 ChemComp-HOH / water


分子量: 18.015 Da / 分子数: 776 / 由来タイプ: 天然 / : H2O

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詳細

研究の焦点であるリガンドがあるかY
Has protein modificationN

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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: 2.62 Å3/Da / 溶媒含有率: 53.12 %
結晶化温度: 289 K / 手法: 蒸気拡散法, シッティングドロップ法 / pH: 8.5 / 詳細: 0.2 M Sodium acetate, 0.1 M Tris, 16% (w/v) PEG4000

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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: 19-ID / 波長: 0.9789 Å
検出器タイプ: DECTRIS PILATUS3 S 6M / 検出器: PIXEL / 日付: 2019年3月19日 / 詳細: mirror
放射モノクロメーター: Si 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: 0.9789 Å / 相対比: 1
反射解像度: 1.82→46.9 Å / Num. obs: 257772 / % possible obs: 96.3 % / Observed criterion σ(I): -3 / 冗長度: 3.4 % / Biso Wilson estimate: 33.74 Å2 / CC1/2: 0.987 / Rmerge(I) obs: 0.084 / Rpim(I) all: 0.053 / Rrim(I) all: 0.1 / Χ2: 2.052 / Net I/σ(I): 25.3
反射 シェル解像度: 1.82→1.84 Å / 冗長度: 3.2 % / Rmerge(I) obs: 0.718 / Mean I/σ(I) obs: 1.4 / Num. unique obs: 9761 / CC1/2: 0.783 / Rpim(I) all: 0.447 / Rrim(I) all: 0.85 / Χ2: 0.829 / % possible all: 92

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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
PHENIX1.15.2_3472精密化
HKL-3000データ削減
HKL-3000データスケーリング
HKL-3000位相決定
精密化構造決定の手法: 分子置換
開始モデル: 5UX9
解像度: 1.82→46.9 Å / SU ML: 0.2505 / 交差検証法: FREE R-VALUE / σ(F): 1.96 / 位相誤差: 30.7683
Rfactor反射数%反射Selection details
Rfree0.2377 12605 4.9 %random
Rwork0.1974 ---
obs0.1993 257109 95.97 %-
溶媒の処理減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å
原子変位パラメータBiso mean: 50.99 Å2
精密化ステップサイクル: LAST / 解像度: 1.82→46.9 Å
タンパク質核酸リガンド溶媒全体
原子数20682 0 531 776 21989
拘束条件
Refine-IDタイプDev ideal
X-RAY DIFFRACTIONf_bond_d0.008921805
X-RAY DIFFRACTIONf_angle_d1.006229595
X-RAY DIFFRACTIONf_chiral_restr0.06393147
X-RAY DIFFRACTIONf_plane_restr0.0063745
X-RAY DIFFRACTIONf_dihedral_angle_d16.291612372
LS精密化 シェル
解像度 (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
1.82-1.840.42463360.36687250X-RAY DIFFRACTION85.68
1.84-1.860.36663960.34777935X-RAY DIFFRACTION93.85
1.86-1.890.35914050.3328238X-RAY DIFFRACTION95.78
1.89-1.910.33364210.38131X-RAY DIFFRACTION95.67
1.91-1.930.3683790.29867768X-RAY DIFFRACTION92.16
1.93-1.960.32944290.28358292X-RAY DIFFRACTION96.91
1.96-1.990.2844430.26658352X-RAY DIFFRACTION97.85
1.99-2.020.3244480.26688199X-RAY DIFFRACTION97.96
2.02-2.050.30754380.25738338X-RAY DIFFRACTION97.77
2.05-2.080.29054740.25498287X-RAY DIFFRACTION97.81
2.08-2.120.30174090.24398323X-RAY DIFFRACTION97.76
2.12-2.160.27924390.23488259X-RAY DIFFRACTION97.71
2.16-2.20.29144540.23438243X-RAY DIFFRACTION97.73
2.2-2.240.29814350.22788312X-RAY DIFFRACTION97.45
2.24-2.290.28954360.22028331X-RAY DIFFRACTION97.34
2.29-2.350.25294110.2137832X-RAY DIFFRACTION93.82
2.35-2.40.27613970.22038429X-RAY DIFFRACTION97.95
2.4-2.470.28114190.21638285X-RAY DIFFRACTION98.02
2.47-2.540.2964150.21798406X-RAY DIFFRACTION97.88
2.54-2.620.25854130.20568264X-RAY DIFFRACTION98.06
2.62-2.720.25164420.20288440X-RAY DIFFRACTION98.22
2.72-2.830.25744640.20348226X-RAY DIFFRACTION98.5
2.83-2.960.23984450.19988310X-RAY DIFFRACTION97.77
2.96-3.110.26114050.20998174X-RAY DIFFRACTION94.82
3.11-3.310.22583720.20088308X-RAY DIFFRACTION98.3
3.31-3.560.22015130.19058214X-RAY DIFFRACTION97.63
3.56-3.920.21534190.17538175X-RAY DIFFRACTION96.05
3.92-4.490.19023240.15427359X-RAY DIFFRACTION86.29
4.49-5.650.17864290.14737647X-RAY DIFFRACTION90.52
5.65-46.90.18353950.16588177X-RAY DIFFRACTION95.84
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)
11.55200261520.09704967863161.267613643373.79502892540.5284615783098.13477666351-0.0829866020385-0.106084481650.382889876286-0.065010456195-0.0295501602720.433069361521-0.3953991574-0.6734450039190.1277654832640.4959230089530.0565249655222-0.05191336365090.3412413129390.07046556395240.433370473378-11.504340715516.9539591614-4.57703726169
28.897046442282.5069749189-1.783131014092.88368812098-2.952604595794.251587688620.219760640405-0.9987914703760.6183647606290.818080684673-0.03895146294570.305231207351-0.571601220494-0.396890032159-0.2047606595730.6226905049480.09298354329980.03791002561020.423709650888-0.03432982807420.475197577855-9.777786565216.726482232811.6530239829
30.988810303394-0.2537997629321.251916939152.55608506901-1.337015830586.17462721537-0.0460888943713-0.1431813547050.1939072828920.394486940927-0.03328277684970.0776782829194-0.268270570166-0.151771915250.1014803601240.499524368993-0.0242907781197-0.0230231970710.3190618573760.01632650286130.2973549341351.1122601900112.585073226211.501566189
41.628955047410.222778438496-0.2454973035163.42718460544-1.807821663072.97693157308-0.03724926181390.009431747407920.1207775830020.00474596249931-0.0612545315705-0.218464003174-0.2086016405720.06666593059020.09771577517320.546013164218-0.0409452652529-0.0399854226830.2856200968440.04096575790150.3195278268418.2770115052123.7016515906-12.2447032591
56.052110045180.386597861751-2.228357189572.20524061884-1.747568983733.967617202150.3651864655970.135303672344-0.1470897764140.03295479112490.0409440875561.512704052230.406519529467-0.67475059402-0.2980055657930.6084111002650.00101174079642-0.0341268877510.3742231076790.002732589061470.429453629803-14.63109404250.4494940144716.2447717078
61.189359214650.863201602274-0.2795747699112.824814632192.157817229722.602078966740.108902404664-0.0658341394374-0.06029627076050.7769465661180.08697289397420.3659393736530.112508339306-0.00666730371762-0.2737759654920.342794481648-0.0124177732848-0.02441945583180.3516546582720.06558499720560.362044255122-8.91869111775-6.169178820815.5031238565
76.259607345043.24155050873-1.927259263276.78703231394-2.087804947256.23052182343-0.151302580044-0.248161848892-0.388692668946-0.295799832705-0.007748192770321.473819731510.512615960397-0.8581770620220.1314743955780.351433623207-0.0168126865940.03206480546340.4507192104170.06970650947160.632073424322-13.1705734675-19.20963696839.21020514608
83.158551692590.2927433090790.136147604766.499410117632.404915501213.591212533090.118276327441-0.0941288764258-0.4438279851140.735844024882-0.21807341225-0.02486749970660.612456343294-0.1537746238930.05020419602430.64785202166-0.01429748595230.01911311462320.2944702742640.08218947606940.308738128221-3.30194927081-17.482808877316.0149854588
90.6916713885520.1828645138490.358074781873.087698666251.52950810813.21450456671-0.0229032371721-0.0990422789391-0.03952481576080.319358318546-0.02545022506680.0908712287880.213971286253-0.01494690328690.0336683600060.285236392850.00704312768341-0.03867389599220.2721616076520.06935039520250.326048234582.05569185071-13.99304861015.48199335566
100.8182553556261.1698668874-0.04384225242294.743465698012.493668730342.221016186170.2374022086460.0718997672139-0.2799544425640.3502748286090.18669200752-0.5483191905070.1522026881280.77392904784-0.4079294814430.296302332704-0.0300501487269-0.08993720588940.4255307624310.07027729949860.58833642455115.2609275449-0.7310778169313.5852558714
112.003791408393.81240092102-0.2934989897334.03432072270.2210083772182.55804034873-0.237406302103-0.666215725286-0.7620949003610.610372790601-0.142273964943-0.3252148086791.061526191231.3622380550.2309824476130.7435357947620.146469897835-0.2912652162990.7095817263860.03843878518330.51660295197818.1789454516-5.3859106913927.6616656779
123.66636678738-0.306824251063-0.6258904433331.37473279517-0.8331611766557.525047024160.261496827288-0.477467638028-0.05347072331150.920138450977-0.0307410613905-0.0461684720687-0.2941300530810.124122148401-0.2079288409211.09537524815-0.0199968370994-0.1533231455890.5345262924230.01365280028520.3556014401055.72183945818-0.60676593370634.4195920948
136.38242516882-0.984083437086-1.377600568822.36410991315-2.43988831444.48559458570.0701213962584-1.09284432058-0.06665667222940.949822311553-0.308881675267-0.5956188064410.2056735038051.092354233130.2306227072171.103592359010.0400634197726-0.2783255178090.6370531980320.0527261029250.45837108445213.9050387154-2.0991741106638.7126369112
142.100910974011.15485605953-0.1357312789454.384562774570.3136536817583.32235083038-0.05543299770360.285538135017-0.211485148747-0.5431415191230.05475027622460.70409102043-0.412865432245-0.474442151333-0.1978489124270.398865505218-0.0159771926089-0.224572634260.3657909612710.07661815533540.619550988156-14.4099077195-13.2493722762-12.8301750509
152.608944192741.34637903159-0.6888043465594.674946140760.9030279353735.56641281040.0379406790056-0.07085005388820.0118607593987-0.07147945556230.2399752802710.40694747925-0.417275704158-0.48607932181-0.2137470845020.3498005325960.02822024125010.02503338995230.3183971231240.0514115079730.417143750163-12.0576210198-8.45844470518-6.29204654115
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631.76331499974-0.5252320268430.3171769358325.71327394884-3.489578373864.46297813260.0868532040147-0.208048237750.1620633215960.223104293368-0.141605715442-0.495992662419-0.07189933863220.1965799637210.05215901906040.495716548373-0.0387247656886-0.08153490355350.273542682987-0.02432763896880.29574747917524.3886505296-53.8015916126-22.5359112533
641.97547576633-2.298441707780.7872842630047.48345860162-0.2095817803894.15886196169-0.146800407033-0.2111800384691.514218758120.139609564043-0.14669912313-1.37971560987-0.378830998671.031103136220.2542351620750.792963066765-0.148696268636-0.009018756236950.54229011650.024873790640.89366568539426.9968923089-36.0877188902-24.926257256
650.563480164498-0.0196145559435-0.69274578662.83085122097-2.840132221425.277748148360.0485428039774-0.1523467601620.1699405295290.256298800012-0.0469862339017-0.178583616717-0.3007120661280.1377414134920.006068203278660.532576639526-0.0253536771752-0.01399693791560.230547527286-0.01678661695070.27408109947517.7204328688-43.7258145409-33.5142703234
665.134868978423.92807503246-4.322382924937.03863754762-5.380774910884.706035794870.08319893370750.02272630065850.554750482680.5737656041240.08734837182220.0351226407206-0.782169731121-0.10181890278-0.1643552235570.665797329802-0.00446958375956-0.03235533862510.300279350359-0.003866340397890.39527269615217.2996809154-33.2185628909-35.6155186237
672.657582809550.935288892813-0.4832203245442.69133549480.1778106497521.500076861230.0990109821551-0.2218648402370.03984541105250.311324008306-0.02194217875370.0519750866728-0.203233724539-0.0911977819451-0.04901931260090.6224672610220.0101809137878-0.01407028576180.2590640876370.007752297290560.2260161073888.83009093422-55.3213764851-23.1331157351
683.23464553266-0.843752296905-1.3482363683.350327434550.7535890699588.657408750550.1428201629860.15416973357-0.158862270948-0.5000699987750.03243084764160.3106959529860.0413447440316-0.80035438869-0.1135511760270.549830065852-0.02690513994730.007987073345720.2567213965560.03107829502160.304852269498-0.0716076696616-60.4737162738-22.1496086041
692.368792647780.9483337556091.264663223492.097352501390.7189721048726.912320567270.11297683907-0.6266503099390.06345989932561.02100621828-0.1232454189840.150667722601-0.134540035602-0.2425489989170.02031145754961.005038555090.02213814466990.05612504800980.524899010786-0.02780263536390.2827602649015.83628892003-58.9394473102-3.25058063978
704.77283622072-1.422604699720.8175007632412.459052204251.040295511251.968392953060.00250303532966-0.7241995889920.07444620134211.32138268232-0.1003454133280.215667754753-0.416602583634-0.947110113340.08875042245630.9875114782080.05604992404420.09931799195910.7902277000990.02697837480850.300050401771.09327300593-58.42520924113.18057022561
711.74208898892-0.3956600091910.2358350715424.947094234560.05735107358767.85739403954-0.06680610243790.238914902163-0.0146285745388-0.3070526007660.034025676641-0.4833336464610.09186405339720.6108542876870.007244439462260.281868319782-0.01234385219550.001845824022580.3067877558690.03757524808030.38348898920128.9631357952-49.607707362325.1506093878
725.90658352767-0.4586954291151.017334353226.92977931052-3.751350574284.865264710660.5768738300090.747642980895-0.735358551908-0.927061911296-0.312820921563-0.8110925298860.3652904883960.662359272186-0.2177403969350.5681319939840.0671258438862-0.04044977817620.418418831169-0.1319287152520.4886343422826.8227927076-65.459262010915.2138061334
730.4239325098370.514726793392-0.1402442282164.67314088908-0.3680907886680.784697075034-0.05863063163310.201975619635-0.132122104562-0.718526324234-0.01169903529530.0132012909140.0590162842096-0.001047301927570.09706698694910.438435835114-0.000836800826425-0.04328502920310.295736290171-0.04759224434340.29589966057916.3246223568-65.231183514121.2494999162
740.680311958102-0.2283544838350.1349361454695.41836943771-2.308017480552.418322162970.03265696494470.1875958423910.0554047849871-0.07033181551120.03935731838390.247820732477-0.295416295364-0.0112761145049-0.09398206960060.380588715350.00755710479262-0.05833518208870.3100575707320.03479256811590.2663125834259.19831639046-38.717477266320.6935016017
757.12876363731.10767590809-1.820283947410.970387378499-2.314795780555.40152873063-0.0586380858982-0.158523394008-0.428420740522-0.442524477849-0.442226157832-1.260977407120.5743467330950.6670584630840.5251131242620.4471229682140.057225878163-0.03104701746170.331454913957-0.01221918320280.6026257212131.2193687658-74.41796182830.5755734096
761.800125802511.2196504891-1.193822324713.105309635371.25945410784.401356276430.0482614218288-0.203169838945-0.3890784452780.529599334195-0.243444853014-0.6412220501610.9965550940320.749829631302-0.0793594916192-0.07846271784540.0359261806404-0.0817694384770.355374570776-0.04549354831550.56889241051125.2134230797-76.502925030136.9845667562
772.79571682637-2.512234804290.4889216287073.5461359538-2.524293674325.35119141164-0.1261835055550.0751963119435-0.4548851918511.52462289419-0.0568656612128-1.551437463750.4029576668581.2655742730.08713876757950.7672969490110.0450860615214-0.2685637374510.4390828917040.08793370119830.72473591543428.2031671141-75.784994527151.3083244879
781.23040801870.0719574617797-0.4806279059541.017430718470.9130238072863.35460413833-0.00897547174971-0.241616365035-0.3693119338590.9193572664380.0235447120214-0.1260667906390.4774737338210.343436111514-0.09963576732140.733444228394-0.019465337193-0.06903080422060.2943308892320.06106708237290.43010107587816.9883793742-74.498570707249.1655984403
790.9394330475360.08577533974850.9770654404991.485250819250.1539125208923.178924233920.0521900901532-0.189433209475-0.2359890262330.721322999649-0.0785394673062-0.04811433227460.131654218731-0.0161267494823-0.02253081668230.543172643251-0.0424402929887-0.0181657430020.2644539088620.04350899421330.32969584747312.9908787454-71.334804896847.0549617877
802.077549996251.216135668510.1964799588459.104592653.642434173993.892212781330.002820378509270.23545657175-0.499824386625-0.157338232593-0.01167686402420.1525568246150.675882381084-0.2915717494750.004185815216720.484549094723-0.0709245306446-0.04065475948690.345410062674-0.03822891399580.4499922057755.43723330952-88.100927840725.6557722402
811.603132873151.059993987560.9035150013812.61425415366-1.67176407372.964467326790.0580629836415-0.157996333715-0.1982629341690.902214106009-0.280667338597-0.890415117985-0.2734016479640.2621095745380.158192214430.64646317507-0.0447103131687-0.1691040015990.3346389930690.07373594632080.4688812866328.4713246833-53.308000535551.1787831485
823.354098986772.1155142517-2.95906012955.695289437141.771049263656.25780180970.184830786202-0.273942464661.33001295510.5810711926320.285946670171-0.57035733458-1.185395366790.561779496929-0.4756357026420.971320183392-0.0993035077416-0.1257458626640.4005326843990.03205314015950.64780730188229.1907261024-34.264973721545.5654681565
831.05569568550.2551869560280.0539940750931.76160894033-0.3845074421881.591984347620.0839073788402-0.2735126543160.03073608550240.94808426619-0.09686513749140.172456610979-0.348029513926-0.1038952208140.02938879951830.783567594401-0.01480767031060.02668689017710.303610847298-0.0003265415795180.30390077447612.582490722-49.283514309453.5919883892
精密化 TLSグループ
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 0 through 35 )
2X-RAY DIFFRACTION2chain 'A' and (resid 36 through 67 )
3X-RAY DIFFRACTION3chain 'A' and (resid 68 through 136 )
4X-RAY DIFFRACTION4chain 'A' and (resid 137 through 217 )
5X-RAY DIFFRACTION5chain 'B' and (resid -2 through 17 )
6X-RAY DIFFRACTION6chain 'B' and (resid 18 through 42 )
7X-RAY DIFFRACTION7chain 'B' and (resid 43 through 59 )
8X-RAY DIFFRACTION8chain 'B' and (resid 60 through 75 )
9X-RAY DIFFRACTION9chain 'B' and (resid 76 through 162 )
10X-RAY DIFFRACTION10chain 'B' and (resid 163 through 173 )
11X-RAY DIFFRACTION11chain 'B' and (resid 174 through 183 )
12X-RAY DIFFRACTION12chain 'B' and (resid 184 through 204 )
13X-RAY DIFFRACTION13chain 'B' and (resid 205 through 217 )
14X-RAY DIFFRACTION14chain 'C' and (resid 0 through 28 )
15X-RAY DIFFRACTION15chain 'C' and (resid 29 through 42 )
16X-RAY DIFFRACTION16chain 'C' and (resid 43 through 67 )
17X-RAY DIFFRACTION17chain 'C' and (resid 68 through 105 )
18X-RAY DIFFRACTION18chain 'C' and (resid 106 through 118 )
19X-RAY DIFFRACTION19chain 'C' and (resid 119 through 136 )
20X-RAY DIFFRACTION20chain 'C' and (resid 137 through 162 )
21X-RAY DIFFRACTION21chain 'C' and (resid 163 through 173 )
22X-RAY DIFFRACTION22chain 'C' and (resid 174 through 183 )
23X-RAY DIFFRACTION23chain 'C' and (resid 184 through 204 )
24X-RAY DIFFRACTION24chain 'C' and (resid 205 through 218 )
25X-RAY DIFFRACTION25chain 'D' and (resid 3 through 42 )
26X-RAY DIFFRACTION26chain 'D' and (resid 43 through 67 )
27X-RAY DIFFRACTION27chain 'D' and (resid 68 through 173 )
28X-RAY DIFFRACTION28chain 'D' and (resid 174 through 217 )
29X-RAY DIFFRACTION29chain 'E' and (resid -2 through 21 )
30X-RAY DIFFRACTION30chain 'E' and (resid 22 through 35 )
31X-RAY DIFFRACTION31chain 'E' and (resid 36 through 53 )
32X-RAY DIFFRACTION32chain 'E' and (resid 54 through 67 )
33X-RAY DIFFRACTION33chain 'E' and (resid 68 through 105 )
34X-RAY DIFFRACTION34chain 'E' and (resid 106 through 118 )
35X-RAY DIFFRACTION35chain 'E' and (resid 119 through 162 )
36X-RAY DIFFRACTION36chain 'E' and (resid 163 through 183 )
37X-RAY DIFFRACTION37chain 'E' and (resid 184 through 204 )
38X-RAY DIFFRACTION38chain 'E' and (resid 205 through 218 )
39X-RAY DIFFRACTION39chain 'F' and (resid 2 through 12 )
40X-RAY DIFFRACTION40chain 'F' and (resid 13 through 24 )
41X-RAY DIFFRACTION41chain 'F' and (resid 25 through 42 )
42X-RAY DIFFRACTION42chain 'F' and (resid 43 through 59 )
43X-RAY DIFFRACTION43chain 'F' and (resid 60 through 75 )
44X-RAY DIFFRACTION44chain 'F' and (resid 76 through 136 )
45X-RAY DIFFRACTION45chain 'F' and (resid 137 through 204 )
46X-RAY DIFFRACTION46chain 'F' and (resid 205 through 218 )
47X-RAY DIFFRACTION47chain 'G' and (resid -2 through 12 )
48X-RAY DIFFRACTION48chain 'G' and (resid 13 through 24 )
49X-RAY DIFFRACTION49chain 'G' and (resid 25 through 53 )
50X-RAY DIFFRACTION50chain 'G' and (resid 54 through 67 )
51X-RAY DIFFRACTION51chain 'G' and (resid 68 through 105 )
52X-RAY DIFFRACTION52chain 'G' and (resid 106 through 136 )
53X-RAY DIFFRACTION53chain 'G' and (resid 137 through 162 )
54X-RAY DIFFRACTION54chain 'G' and (resid 163 through 183 )
55X-RAY DIFFRACTION55chain 'G' and (resid 184 through 204 )
56X-RAY DIFFRACTION56chain 'G' and (resid 205 through 217 )
57X-RAY DIFFRACTION57chain 'H' and (resid 3 through 42 )
58X-RAY DIFFRACTION58chain 'H' and (resid 43 through 67 )
59X-RAY DIFFRACTION59chain 'H' and (resid 68 through 151 )
60X-RAY DIFFRACTION60chain 'H' and (resid 152 through 204 )
61X-RAY DIFFRACTION61chain 'H' and (resid 205 through 218 )
62X-RAY DIFFRACTION62chain 'I' and (resid -2 through 21 )
63X-RAY DIFFRACTION63chain 'I' and (resid 22 through 53 )
64X-RAY DIFFRACTION64chain 'I' and (resid 54 through 67 )
65X-RAY DIFFRACTION65chain 'I' and (resid 68 through 105 )
66X-RAY DIFFRACTION66chain 'I' and (resid 106 through 118 )
67X-RAY DIFFRACTION67chain 'I' and (resid 119 through 162 )
68X-RAY DIFFRACTION68chain 'I' and (resid 163 through 173 )
69X-RAY DIFFRACTION69chain 'I' and (resid 174 through 204 )
70X-RAY DIFFRACTION70chain 'I' and (resid 205 through 218 )
71X-RAY DIFFRACTION71chain 'J' and (resid 0 through 42 )
72X-RAY DIFFRACTION72chain 'J' and (resid 43 through 67 )
73X-RAY DIFFRACTION73chain 'J' and (resid 68 through 136 )
74X-RAY DIFFRACTION74chain 'J' and (resid 137 through 217 )
75X-RAY DIFFRACTION75chain 'K' and (resid -2 through 17 )
76X-RAY DIFFRACTION76chain 'K' and (resid 18 through 42 )
77X-RAY DIFFRACTION77chain 'K' and (resid 43 through 59 )
78X-RAY DIFFRACTION78chain 'K' and (resid 60 through 95 )
79X-RAY DIFFRACTION79chain 'K' and (resid 96 through 162 )
80X-RAY DIFFRACTION80chain 'K' and (resid 163 through 217 )
81X-RAY DIFFRACTION81chain 'L' and (resid 1 through 53 )
82X-RAY DIFFRACTION82chain 'L' and (resid 54 through 67 )
83X-RAY DIFFRACTION83chain 'L' and (resid 68 through 217 )

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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