+データを開く
-基本情報
登録情報 | データベース: PDB / ID: 1hum | ||||||
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タイトル | SOLUTION STRUCTURE OF THE CHEMOKINE HMIP-1BETA(SLASH)ACT-2 BY MULTI-DIMENSIONAL NMR: A NOVEL CHEMOKINE DIMER | ||||||
要素 | HUMAN MACROPHAGE INFLAMMATORY PROTEIN 1 BETA | ||||||
キーワード | CYTOKINE(CHEMOTACTIC) | ||||||
機能・相同性 | 機能・相同性情報 CCR1 chemokine receptor binding / positive regulation of natural killer cell chemotaxis / CCR5 chemokine receptor binding / CCR chemokine receptor binding / lymphocyte chemotaxis / positive regulation of calcium ion transport / eosinophil chemotaxis / chemokine-mediated signaling pathway / Chemokine receptors bind chemokines / chemokine activity ...CCR1 chemokine receptor binding / positive regulation of natural killer cell chemotaxis / CCR5 chemokine receptor binding / CCR chemokine receptor binding / lymphocyte chemotaxis / positive regulation of calcium ion transport / eosinophil chemotaxis / chemokine-mediated signaling pathway / Chemokine receptors bind chemokines / chemokine activity / establishment or maintenance of cell polarity / Interleukin-10 signaling / monocyte chemotaxis / negative regulation by host of viral transcription / cellular response to interleukin-1 / positive regulation of calcium-mediated signaling / 好中球 / cytokine activity / response to virus / response to toxic substance / cellular response to type II interferon / cell-cell signaling / cellular response to tumor necrosis factor / G alpha (i) signalling events / positive regulation of ERK1 and ERK2 cascade / 細胞接着 / 免疫応答 / 炎症 / G protein-coupled receptor signaling pathway / シグナル伝達 / extracellular space / extracellular region / identical protein binding 類似検索 - 分子機能 | ||||||
生物種 | Homo sapiens (ヒト) | ||||||
手法 | 溶液NMR | ||||||
データ登録者 | Clore, G.M. / Lodi, P.J. / Garrett, D.S. / Gronenborn, A.M. | ||||||
引用 | ジャーナル: Science / 年: 1994 タイトル: High-resolution solution structure of the beta chemokine hMIP-1 beta by multidimensional NMR. 著者: Lodi, P.J. / Garrett, D.S. / Kuszewski, J. / Tsang, M.L. / Weatherbee, J.A. / Leonard, W.J. / Gronenborn, A.M. / Clore, G.M. | ||||||
履歴 |
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-構造の表示
構造ビューア | 分子: MolmilJmol/JSmol |
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-ダウンロードとリンク
-ダウンロード
PDBx/mmCIF形式 | 1hum.cif.gz | 53 KB | 表示 | PDBx/mmCIF形式 |
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PDB形式 | pdb1hum.ent.gz | 43.1 KB | 表示 | PDB形式 |
PDBx/mmJSON形式 | 1hum.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
アーカイブディレクトリ | https://data.pdbj.org/pub/pdb/validation_reports/hu/1hum ftp://data.pdbj.org/pub/pdb/validation_reports/hu/1hum | HTTPS FTP |
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-関連構造データ
-リンク
-集合体
登録構造単位 |
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NMR アンサンブル |
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-要素
#1: タンパク質 | 分子量: 7824.742 Da / 分子数: 2 / 由来タイプ: 組換発現 / 由来: (組換発現) Homo sapiens (ヒト) / 参照: UniProt: P13236 #2: 水 | ChemComp-HOH / | |
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-実験情報
-実験
実験 | 手法: 溶液NMR |
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-試料調製
結晶化 | *PLUS 手法: その他 / 詳細: NMR |
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-解析
精密化 | ソフトェア番号: 1 詳細: RESTRAINED MINIMIZED AVERAGE STRUCTURE OVER 35 FILES AVE.RMS DIFF. TO MEAN FOR BACKBONE (4-69)= 0.304637 ANGSTROMS AVE.RMS DIFF. TO MEAN FOR ALL ORDERED NON-H-ATOMS (4-69)= 0.45 ANGSTROMS AVE. ...詳細: RESTRAINED MINIMIZED AVERAGE STRUCTURE OVER 35 FILES AVE.RMS DIFF. TO MEAN FOR BACKBONE (4-69)= 0.304637 ANGSTROMS AVE.RMS DIFF. TO MEAN FOR ALL ORDERED NON-H-ATOMS (4-69)= 0.45 ANGSTROMS AVE.RMS DIFF. TO MEAN FOR ALL NON-H-ATOMS (4-69)= 0.706906 ANGSTROMS THE 3D STRUCTURE OF THE HMIP-1BETA DIMER IN SOLUTION BY NMR IS BASED ON 3586 EXPERIMENTAL RESTRAINTS COMPRISING: 3132 STRUCTURE USEFUL INTERPROTON DISTANCE RESTRAINTS OF WHICH 228 ARE INTERSUBUNIT; 24 RESTRAINTS FOR 12 H-BONDS INVOLVING TIGHTLY BOUND WATER MOLECULES; 108 RESTRAINTS FOR 54 BACKBONE HYDROGEN BONDS INVOLVING SLOWLY EXCHANGING AMIDE PROTONS; 220 TORSION ANGLE RESTRAINTS (122 PHI, 10 PSI, 80 CHI1 AND 8 CHI2); AND 102 HN-HALPHA THREE-BOND COUPLING CONSTANTS. A COMPLETE LIST OF EXPERIMENTAL RESTRAINTS AND 1H, 13C AND 15N ASSIGNMENTS ARE AVAILABLE FROM THE PROTEIN DATA BANK AS A SEPARATE ENTRY. THE STRUCTURES ARE CALCULATED USING THE HYBRID METRIC MATRIX DISTANCE GEOMETRY-DYNAMICAL SIMULATED ANNEALING METHOD DESCRIBED BY: NILGES, M., CLORE, G.M. & GRONENBORN, A.M. (1988) FEBS LETT 229, 317-324. ALL STRUCTURAL STATISTICS ARE GIVEN IN THE REFERENCE. THIS ENTRY CORRESPONDS TO THE RESTRAINED MINIMIZED AVERAGE STRUCTURE: (SA)R. THIS IS OBTAINED BY FIRST AVERAGING THE COORDINATES OF THE INDIVIDUAL 35 DYNAMICAL SIMULATED ANNEALING SA STRUCTURES BEST FITTED TO RESIDUES A 4 - A 69 (CHAIN A) AND B 4 - B 69 (CHAIN B), AND SUBJECTING THE RESULTING COORDINATES TO RESTRAINED MINIMIZATION. THE FIELD THAT CONTAINS THE B VALUE IN X-RAY STRUCTURES (COLUMNS 61 - 66) GIVES THE AVERAGE RMS DIFFERENCE BETWEEN THE INDIVIDUAL SA STRUCTURES AND THE MEAN STRUCTURE. |
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NMRアンサンブル | 登録したコンフォーマーの数: 1 |