4MSV

Crystal structure of FASL and DcR3 complex

> 概要

4MSV の概要

関連するPDBエントリー4EN0 3MHD 4J6G 4KGG 4KGQ 3K51
分子名称Tumor necrosis factor receptor superfamily member 6B, Tumor necrosis factor ligand superfamily member 6, MAGNESIUM ION, ... (5 entities in total)
機能のキーワードfasl, dcr3, tnf, tnfr, tnf6, structural genomics, psi-biology, new york structural genomics, research consortium, nysgrc, immunity, tnf supe cd95l, fas ligand, membrane, atoms-to-animals: the immune function network, ifn, jelly-roll fold, bind tnf receptor fas, protein structure initiative, new york structural genomics research consortium, cd95l, tnf superfamily, secreted protein, cytokine, immune system
由来する生物種Homo sapiens (human)
細胞内の位置Cell membrane; Single-pass type II membrane protein. Tumor necrosis factor ligand superfamily member 6, soluble form: Secreted . FasL intracellular domain: Nucleus P48023
Secreted O95407
ポリマー鎖数2
分子量合計36505.79
構造登録者
主引用文献
Liu, W.,Ramagopal, U.,Cheng, H.,Bonanno, J.B.,Toro, R.,Bhosle, R.,Zhan, C.,Almo, S.C.
Crystal Structure of the Complex of Human FasL and Its Decoy Receptor DcR3.
Structure, 24:2016-2023, 2016
PubMed: 27806260 (主引用文献が同じPDBエントリー)
DOI: 10.1016/j.str.2016.09.009
MImport into Mendeley
実験手法
X-RAY DIFFRACTION (2.5 Å)
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構造検証レポート

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.223305.0%4.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
検証レポート(詳細版)をダウンロード

他の静止画像(非対称単位)

Molmil generated image of 4msv
回転なし
Molmil generated image of 4msv
x軸(左右方向)周りに90°回転
Molmil generated image of 4msv
y軸(上下方向)周りに90°回転

他の静止画像(生物学的単位)

Molmil generated image of 4msv
回転なし
Molmil generated image of 4msv
x軸(左右方向)周りに90°回転
Molmil generated image of 4msv
y軸(上下方向)周りに90°回転
(*)表面構造(coarse surface)で表現されている場合、非対称単位は、赤色のリボンモデルで表示されています。
生物学的単位の座標ファイル (4msv.pdb1.gz [147.7 KB])

> 構造情報

エンティティ

鎖名説明種類鎖長分子量分子数データベース名(アクセス番号)由来する生物種エンティティの一般名
BTumor necrosis factor receptor superfamily member 6Bpolymer17419044.31
UniProt (O95407)
Pfam (PF00020)
Homo sapiens (human)@PDBjDecoy receptor 3, DcR3, Decoy receptor for Fas ligand, M68
ATumor necrosis factor ligand superfamily member 6polymer15217345.11
UniProt (P48023)
Pfam (PF00229)
Homo sapiens (human)@PDBjApoptosis antigen ligand, APTL, CD95 ligand, CD95-L, Fas antigen ligand, Fas ligand, FasL, Tumor necrosis factor ligand superfamily member 6, membrane form, Tumor necrosis factor ligand superfamily member 6, soluble form, Receptor-binding FasL ectodomain, Soluble Fas ligand, sFasL, ADAM10-processed FasL form, APL, FasL intracellular domain, FasL ICD, SPPL2A-processed FasL form, SPA
MAGNESIUM IONnon-polymer24.31
GLYCEROLnon-polymer92.11
waterwater18.063

配列ビューア

非対称単位の内容

ポリマー鎖の数2
分子量合計36389.4
非ポリマー*分子数2
分子量合計116.4
全て*分子量合計36505.8
*水分子は含んでいません

> 実験情報

精密化の統計情報

実験手法:X-RAY DIFFRACTION (2.5 Å)

格子定数 [Å]126.909126.909205.729
格子定数 [度]90.0090.00120.00
空間群H 3 2
分解能 [Å] (低 - 高)48.52 - 2.50
最も高い分解能シェルの値2.561 - 2.496
R因子0.18914
R-work0.18744
最も高い分解能シェルの値0.294
R-free0.22075
最も高い分解能シェルの値0.390
結合長の平均二乗偏差(RMSD) [Å]0.022
結合角の平均二乗偏差(RMSD) [度]2.036

回折データの統計情報

分解能 [Å] (低 - 高)50.00 - 2.50
最も高い分解能シェルの値 -
独立反射数22326
Rmerge_l_obs0.116
最も高い分解能シェルの値0.826
完全性 [%]100.0
冗長性7.3
最も高い分解能シェルの値7

結晶化条件

結晶ID方法pHpHの範囲温度単位
1VAPOR DIFFUSION, SITTING DROP7290

結晶化試薬

ID結晶ID濃度試薬名濃度 (単位)詳細
文献の結晶化試薬*
ID結晶ID溶液試薬名濃度 (単位) (単位)詳細
注釈情報は下記文献より抽出しています*

> 機能情報

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GO(遺伝子オントロジー)由来の情報

鎖名GO(遺伝子オントロジー)id名前空間内容
B0005576cellular_componentextracellular region
B0005615cellular_componentextracellular space
B0005887cellular_componentintegral component of plasma membrane
B0004872molecular_functionreceptor activity
B0005031molecular_functiontumor necrosis factor-activated receptor activity
B0097190biological_processapoptotic signaling pathway
B0006955biological_processimmune response
B0006954biological_processinflammatory response
B0007275biological_processmulticellular organism development
B0043066biological_processnegative regulation of apoptotic process
B0042127biological_processregulation of cell proliferation
B0032496biological_processresponse to lipopolysaccharide
B0033209biological_processtumor necrosis factor-mediated signaling pathway
A0005901cellular_componentcaveola
A0060205cellular_componentcytoplasmic vesicle lumen
A0009897cellular_componentexternal side of plasma membrane
A0070062cellular_componentextracellular exosome
A0005576cellular_componentextracellular region
A0005615cellular_componentextracellular space
A0005887cellular_componentintegral component of plasma membrane
A0043202cellular_componentlysosomal lumen
A0005634cellular_componentnucleus
A0048471cellular_componentperinuclear region of cytoplasm
A0005886cellular_componentplasma membrane
A0005125molecular_functioncytokine activity
A0005123molecular_functiondeath receptor binding
A0005102molecular_functionreceptor binding
A0005164molecular_functiontumor necrosis factor receptor binding
A0006919biological_processactivation of cysteine-type endopeptidase activity involved in apoptotic process
A0097296biological_processactivation of cysteine-type endopeptidase activity involved in apoptotic signaling pathway
A0006915biological_processapoptotic process
A0097190biological_processapoptotic signaling pathway
A1903514biological_processrelease of sequestered calcium ion into cytosol by endoplasmic reticulum
A0007267biological_processcell-cell signaling
A0030644biological_processcellular chloride ion homeostasis
A0048388biological_processendosomal lumen acidification
A0097191biological_processextrinsic apoptotic signaling pathway
A0008625biological_processextrinsic apoptotic signaling pathway via death domain receptors
A0006955biological_processimmune response
A0006925biological_processinflammatory cell apoptotic process
A0070266biological_processnecroptotic process
A0097527biological_processnecroptotic signaling pathway
A0016525biological_processnegative regulation of angiogenesis
A1902042biological_processnegative regulation of extrinsic apoptotic signaling pathway via death domain receptors
A0000122biological_processnegative regulation of transcription from RNA polymerase II promoter
A0043065biological_processpositive regulation of apoptotic process
A0008284biological_processpositive regulation of cell proliferation
A2000353biological_processpositive regulation of endothelial cell apoptotic process
A0045742biological_processpositive regulation of epidermal growth factor receptor signaling pathway
A0043123biological_processpositive regulation of I-kappaB kinase/NF-kappaB signaling
A0043525biological_processpositive regulation of neuron apoptotic process
A1902041biological_processregulation of extrinsic apoptotic signaling pathway via death domain receptors
A0070848biological_processresponse to growth factor
A0032496biological_processresponse to lipopolysaccharide
A0046666biological_processretinal cell programmed cell death
A0007165biological_processsignal transduction
A0070231biological_processT cell apoptotic process
A0006351biological_processtranscription, DNA-templated
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PDBデータベースに由来する情報

site_id残基数詳細
AC16BINDING SITE FOR RESIDUE MG B 301
鎖名残基
BCYS132
BPRO133
BALA136
BSER159
BSER161
BHOH424

AC26BINDING SITE FOR RESIDUE GOL A 301
鎖名残基
AASN215
ATYR218
AGLN220
ALEU222
BLEU85
BARG89

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「HETATM」原子の座標から抽出されたリガンド結合部位

site_id残基数詳細
GOL_4msv_A_30110GLYCEROL binding site
鎖名残基ligand
BLEU85GOL: GLYCEROL
BARG89GOL: GLYCEROL
AMET213-ASN215GOL: GLYCEROL
ATYR218-LEU222GOL: GLYCEROL

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UniProtにおけるモチーフ・データベースPROSITEからの機能情報

site_id残基数詳細
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SwissProt/UniProtに記載されている蛋白質分子機能情報

site_id残基数詳細
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CSAにおける酵素触媒機能の情報

site_id残基数詳細

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