A hexamer model can be created that aligns well with the N-terminal Methanobacterium thermoautotrophicum MCM hexamer (PDB ID 1LTL) using the following non-crystallographic matrices. Apply matrix 1 for monomer 1, and then apply the summation of matrix 1 and matrix N to create monomer N, where N is 2-6. 1) LSQ_RT_NTTONTAIMP R 12 (3f14.8) 0.43327817 0.61568034 0.65818518 -0.90081984 0.31867027 0.29491171 -0.02817271 -0.72068506 0.69268990 239.07376099 11.87045383 -79.62718964 2) LSQ_RT_ATOB2IMP R 12 (3f14.8) 0.50902790 -0.86062968 -0.01439116 0.86053950 0.50920200 -0.01360237 0.01903461 -0.00546018 0.99980390 -0.94980073 110.48052979 1.74927461 3) LSQ_RT_ATOCIMP R 12 (3f14.8) -0.49999857 0.86602622 -0.00000035 -0.86602622 -0.49999857 0.00000028 0.00000007 0.00000044 1.00000000 192.32089233 -0.00009566 0.00002129 4) LSQ_RT_ATODIMP R 12 (3f14.8) 0.49081263 0.87114632 -0.01439028 -0.87125200 0.49064746 -0.01360218 -0.00478894 0.01921368 0.99980396 97.11698151 -56.06281281 1.74919856 5) LSQ_RT_ATOEIMP R 12 (3f14.8) -0.49999991 -0.86602545 -0.00000097 0.86602545 -0.49999991 0.00000114 -0.00000147 -0.00000028 1.00000000 96.16052246 166.55490112 0.00005019 6) LSQ_RT_ATOFIMP R 12 (3f14.8) -0.99984115 -0.01051573 -0.01439001 0.01071160 -0.99985009 -0.01360323 -0.01424481 -0.01375521 0.99980390 192.31431580 112.13711548 1.74920392
由来: シンクロトロン / サイト: ALS / ビームライン: 8.2.1 / 波長: 0.9794 Å
検出器
タイプ: ADSC / 検出器: CCD / 日付: 2007年10月29日
放射
プロトコル: SAD / 散乱光タイプ: x-ray
放射波長
波長: 0.9794 Å / 相対比: 1
反射
解像度: 4.35→30 Å / Num. obs: 7760
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解析
ソフトウェア
名称
バージョン
分類
NB
REFMAC
5.2.0019
精密化
PDB_EXTRACT
3.006
データ抽出
HKL-2000
データ収集
HKL-2000
データ削減
HKL-2000
データスケーリング
CNS
位相決定
精密化
解像度: 4.35→30 Å / Cor.coef. Fo:Fc: 0.832 / Cor.coef. Fo:Fc free: 0.803 / Occupancy max: 1 / Occupancy min: 1 / SU B: 349.255 / SU ML: 2.069 / TLS residual ADP flag: LIKELY RESIDUAL / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R Free: 1.467 立体化学のターゲット値: MAXIMUM LIKELIHOOD WITH PHASES 詳細: Proline residues identified in remark 500 as having deviant covalent bond angles were modeled as alanines in the structure. As such the standard values used as a reference against these ...詳細: Proline residues identified in remark 500 as having deviant covalent bond angles were modeled as alanines in the structure. As such the standard values used as a reference against these residues are not relevant to a poly-alanine structure.
Rfactor
反射数
%反射
Selection details
Rfree
0.481
343
4.6 %
RANDOM
Rwork
0.412
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-
-
obs
0.415
7390
82.06 %
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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