+データを開く
-基本情報
登録情報 | データベース: PDB / ID: 3w13 | |||||||||
---|---|---|---|---|---|---|---|---|---|---|
タイトル | Insulin receptor ectodomain construct comprising domains L1-CR in complex with high-affinity insulin analogue [D-PRO-B26]-DTI-NH2, alphact peptide(693-719) and FAB 83-7 | |||||||||
要素 |
| |||||||||
キーワード | HORMONE RECEPTOR/HORMONE/IMMUNE SYSTEM / CELL SURFACE RECEPTOR/IMMUNE SYSTEM / INSULIN RECEPTOR / IR ECTODOMAIN / CT PEPTIDE / INSULIN ANALOGUE / HORMONE RECEPTOR-HORMONE-IMMUNE SYSTEM COMPLEX | |||||||||
機能・相同性 | 機能・相同性情報 regulation of female gonad development / positive regulation of meiotic cell cycle / insulin-like growth factor II binding / positive regulation of developmental growth / male sex determination / exocrine pancreas development / insulin receptor complex / insulin-like growth factor I binding / insulin receptor activity / positive regulation of protein-containing complex disassembly ...regulation of female gonad development / positive regulation of meiotic cell cycle / insulin-like growth factor II binding / positive regulation of developmental growth / male sex determination / exocrine pancreas development / insulin receptor complex / insulin-like growth factor I binding / insulin receptor activity / positive regulation of protein-containing complex disassembly / cargo receptor activity / dendritic spine maintenance / insulin binding / negative regulation of NAD(P)H oxidase activity / negative regulation of glycogen catabolic process / PTB domain binding / adrenal gland development / positive regulation of nitric oxide mediated signal transduction / negative regulation of fatty acid metabolic process / activation of protein kinase activity / negative regulation of feeding behavior / Signaling by Insulin receptor / IRS activation / Insulin processing / neuronal cell body membrane / regulation of protein secretion / positive regulation of peptide hormone secretion / positive regulation of respiratory burst / positive regulation of receptor internalization / negative regulation of acute inflammatory response / Regulation of gene expression in beta cells / alpha-beta T cell activation / amyloid-beta clearance / regulation of amino acid metabolic process / regulation of embryonic development / negative regulation of respiratory burst involved in inflammatory response / insulin receptor substrate binding / negative regulation of protein secretion / positive regulation of dendritic spine maintenance / transport across blood-brain barrier / positive regulation of glycogen biosynthetic process / Synthesis, secretion, and deacylation of Ghrelin / epidermis development / regulation of protein localization to plasma membrane / fatty acid homeostasis / negative regulation of gluconeogenesis / negative regulation of lipid catabolic process / Signal attenuation / FOXO-mediated transcription of oxidative stress, metabolic and neuronal genes / COPI-mediated anterograde transport / phosphatidylinositol 3-kinase binding / heart morphogenesis / positive regulation of lipid biosynthetic process / negative regulation of oxidative stress-induced intrinsic apoptotic signaling pathway / positive regulation of insulin receptor signaling pathway / nitric oxide-cGMP-mediated signaling / negative regulation of reactive oxygen species biosynthetic process / positive regulation of protein autophosphorylation / Insulin receptor recycling / transport vesicle / insulin-like growth factor receptor binding / dendrite membrane / neuron projection maintenance / endoplasmic reticulum-Golgi intermediate compartment membrane / positive regulation of brown fat cell differentiation / positive regulation of protein metabolic process / NPAS4 regulates expression of target genes / activation of protein kinase B activity / positive regulation of glycolytic process / Insulin receptor signalling cascade / positive regulation of mitotic nuclear division / receptor-mediated endocytosis / positive regulation of nitric-oxide synthase activity / learning / positive regulation of cytokine production / positive regulation of long-term synaptic potentiation / acute-phase response / endosome lumen / Regulation of insulin secretion / positive regulation of D-glucose import / positive regulation of protein secretion / negative regulation of proteolysis / positive regulation of cell differentiation / regulation of transmembrane transporter activity / insulin receptor binding / positive regulation of MAP kinase activity / wound healing / receptor protein-tyrosine kinase / caveola / regulation of synaptic plasticity / negative regulation of protein catabolic process / cellular response to growth factor stimulus / receptor internalization / hormone activity / memory / positive regulation of neuron projection development / peptidyl-tyrosine phosphorylation / cognition / cellular response to insulin stimulus / positive regulation of protein localization to nucleus 類似検索 - 分子機能 | |||||||||
生物種 | Homo sapiens (ヒト) Mus musculus (ハツカネズミ) HOMO SAPIENS (ヒト) | |||||||||
手法 | X線回折 / シンクロトロン / 分子置換 / 解像度: 4.303 Å | |||||||||
データ登録者 | Lawrence, M.C. / Smith, B.J. / Brzozowski, A.M. | |||||||||
引用 | ジャーナル: Nature / 年: 2013 タイトル: How insulin engages its primary binding site on the insulin receptor 著者: Menting, J.G. / Whittaker, J. / Margetts, M.B. / Whittaker, L.J. / Kong, G.K.-W. / Smith, B.J. / Watson, C.J. / Zakova, L. / Kletvikova, E. / Jiracek, J. / Chan, S.J. / Steiner, D.F. / ...著者: Menting, J.G. / Whittaker, J. / Margetts, M.B. / Whittaker, L.J. / Kong, G.K.-W. / Smith, B.J. / Watson, C.J. / Zakova, L. / Kletvikova, E. / Jiracek, J. / Chan, S.J. / Steiner, D.F. / Dodson, G.G. / Brzozowski, A.M. / Weiss, M.A. / Ward, C.W. / Lawrence, M.C. | |||||||||
履歴 |
|
-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
-ダウンロード
PDBx/mmCIF形式 | 3w13.cif.gz | 256.4 KB | 表示 | PDBx/mmCIF形式 |
---|---|---|---|---|
PDB形式 | pdb3w13.ent.gz | 209.1 KB | 表示 | PDB形式 |
PDBx/mmJSON形式 | 3w13.json.gz | ツリー表示 | PDBx/mmJSON形式 | |
その他 | その他のダウンロード |
-検証レポート
文書・要旨 | 3w13_validation.pdf.gz | 969 KB | 表示 | wwPDB検証レポート |
---|---|---|---|---|
文書・詳細版 | 3w13_full_validation.pdf.gz | 983 KB | 表示 | |
XML形式データ | 3w13_validation.xml.gz | 24.3 KB | 表示 | |
CIF形式データ | 3w13_validation.cif.gz | 32.1 KB | 表示 | |
アーカイブディレクトリ | https://data.pdbj.org/pub/pdb/validation_reports/w1/3w13 ftp://data.pdbj.org/pub/pdb/validation_reports/w1/3w13 | HTTPS FTP |
-関連構造データ
-リンク
-集合体
登録構造単位 |
| ||||||||
---|---|---|---|---|---|---|---|---|---|
1 |
| ||||||||
単位格子 |
|
-要素
-Insulin receptor ... , 2種, 2分子 EF
#1: タンパク質 | 分子量: 35503.934 Da / 分子数: 1 / 断片: UNP residues 28-337 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 遺伝子: INSR / Cell (発現宿主): CHO CELL / 細胞株 (発現宿主): LEC8 MUTANT 発現宿主: Cricetulus griseus (モンゴルキヌゲネズミ) 参照: UniProt: P06213, receptor protein-tyrosine kinase |
---|---|
#6: タンパク質・ペプチド | 分子量: 2788.073 Da / 分子数: 1 / 断片: UNP residues 724-746 / 由来タイプ: 合成 / 詳細: chemical synthesis / 由来: (合成) HOMO SAPIENS (ヒト) / 参照: UniProt: P06213, receptor protein-tyrosine kinase |
-タンパク質・ペプチド , 2種, 2分子 AB
#4: タンパク質・ペプチド | 分子量: 2383.698 Da / 分子数: 1 / 由来タイプ: 合成 詳細: semi-synthetic modification of porcine insulin derived from porcine pancreas 由来: (合成) HOMO SAPIENS (ヒト) / 参照: UniProt: P01308 |
---|---|
#5: タンパク質・ペプチド | 分子量: 2938.408 Da / 分子数: 1 / 断片: UNP residues 25-50 / 由来タイプ: 合成 詳細: semi-synthetic modification of porcine insulin derived from porcine pancreas 由来: (合成) HOMO SAPIENS (ヒト) / 参照: UniProt: P01308 |
-抗体 , 2種, 2分子 CD
#2: 抗体 | 分子量: 12712.239 Da / 分子数: 1 / 由来タイプ: 組換発現 / 由来: (組換発現) Mus musculus (ハツカネズミ) / Cell (発現宿主): HYBRIDOMA CELL / 発現宿主: Mus musculus (ハツカネズミ) |
---|---|
#3: 抗体 | 分子量: 12684.292 Da / 分子数: 1 / 由来タイプ: 組換発現 / 由来: (組換発現) Mus musculus (ハツカネズミ) / Cell (発現宿主): HYBRIDOMA CELL / 発現宿主: Mus musculus (ハツカネズミ) |
-糖 , 3種, 4分子
#7: 多糖 | alpha-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1- ...alpha-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose |
---|---|
#8: 多糖 | beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta- ...beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose |
#9: 糖 |
-詳細
配列の詳細 | HIS E 144 IS NATURAL VARIANT RS1051692. THE SEQUENCE OF CHIAN F IS ISOFORM SHORT OF INSULIN ...HIS E 144 IS NATURAL VARIANT RS1051692. THE SEQUENCE OF CHIAN F IS ISOFORM SHORT OF INSULIN RECEPTOR, P06213-2. B26 TYR MUTATED TO D-PRO; B27-B30 ARE DELETED; B26 C-TERMINUS IS FINISHED WITH CONH2 (CARBOXYAMI |
---|
-実験情報
-実験
実験 | 手法: X線回折 / 使用した結晶の数: 1 |
---|
-試料調製
結晶 | マシュー密度: 5.968 Å3/Da / 溶媒含有率: 79.39 % / Mosaicity: 0.1 ° |
---|---|
結晶化 | pH: 8 詳細: 0.9-1.1M TRI-SODIUM CITRATE, 0.1M IMIDAZOLE-HCL, 0.02% SOIDUM AZIDE, PH 8.0 |
-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: Diamond / ビームライン: I24 / 波長: 0.9686 Å |
検出器 | タイプ: DECTRIS PILATUS 6M / 検出器: PIXEL / 日付: 2012年3月20日 |
放射 | プロトコル: SINGLE WAVELENGTH / 単色(M)・ラウエ(L): M / 散乱光タイプ: x-ray |
放射波長 | 波長: 0.9686 Å / 相対比: 1 |
反射 | 解像度: 4.303→169.228 Å / Num. all: 11033 / Num. obs: 11033 / % possible obs: 98.5 % / 冗長度: 4.4 % / Rsym value: 0.101 / Net I/σ(I): 8.2 |
反射 シェル | 解像度: 4.303→4.54 Å / 冗長度: 4.3 % / Rmerge(I) obs: 1.09 / Mean I/σ(I) obs: 1.4 / % possible all: 98.1 |
-解析
ソフトウェア |
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
精密化 | 構造決定の手法: 分子置換 開始モデル: 3LOH,2WRW 解像度: 4.303→29.48 Å / Cor.coef. Fo:Fc: 0.892 / Cor.coef. Fo:Fc free: 0.856 / SU B: 160.517 / SU ML: 0.868 / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R Free: 0.974 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: U VALUES: WITH TLS ADDED
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
溶媒の処理 | イオンプローブ半径: 0.8 Å / 減衰半径: 0.8 Å / VDWプローブ半径: 1.2 Å / 溶媒モデル: MASK | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
原子変位パラメータ | Biso mean: 226.59 Å2
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
精密化ステップ | サイクル: LAST / 解像度: 4.303→29.48 Å
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
拘束条件 |
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
LS精密化 シェル | 解像度: 4.303→4.41 Å / Total num. of bins used: 20
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
精密化 TLS | 手法: refined / Refine-ID: X-RAY DIFFRACTION
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
精密化 TLSグループ |
|