THE ORIGINAL NUMBERs OF HOHs HAVE BEEN RENUMBERED. FOR EXAMPLE, HOH(130, CHAIN A) HAS BEEN CHANGED ...THE ORIGINAL NUMBERs OF HOHs HAVE BEEN RENUMBERED. FOR EXAMPLE, HOH(130, CHAIN A) HAS BEEN CHANGED TO HOH(301, CHAIN A). ORIGINAL RENUMBERED HOH(130, CHAIN A) HOH(401, CHAIN A). HOH(131, CHAIN A) HOH(402, CHAIN A). HOH(132, CHAIN A) HOH(403, CHAIN A). HOH(133, CHAIN A) HOH(404, CHAIN A). HOH(134, CHAIN A) HOH(405, CHAIN A). HOH(135, CHAIN A) HOH(406, CHAIN A). HOH(136, CHAIN A) HOH(407, CHAIN A). HOH(137, CHAIN A) HOH(408, CHAIN A). HOH(138, CHAIN A) HOH(409, CHAIN A). HOH(139, CHAIN A) HOH(410, CHAIN A). HOH(140, CHAIN A) HOH(411, CHAIN A). HOH(142, CHAIN A) HOH(412, CHAIN A). HOH(143, CHAIN A) HOH(413, CHAIN A). HOH(144, CHAIN A) HOH(414, CHAIN A). HOH(145, CHAIN A) HOH(415, CHAIN A). HOH(146, CHAIN A) HOH(416, CHAIN A). HOH(147, CHAIN A) HOH(417, CHAIN A). HOH(148, CHAIN A) HOH(418, CHAIN A). HOH(149, CHAIN A) HOH(419, CHAIN A). HOH(150, CHAIN A) HOH(420, CHAIN A). HOH(151, CHAIN A) HOH(421, CHAIN A). HOH(152, CHAIN A) HOH(422, CHAIN A). HOH(154, CHAIN A) HOH(423, CHAIN A). HOH(155, CHAIN A) HOH(424, CHAIN A). HOH(156, CHAIN A) HOH(425, CHAIN A). HOH(157, CHAIN A) HOH(426, CHAIN A). HOH(158, CHAIN A) HOH(427, CHAIN A). HOH(159, CHAIN A) HOH(428, CHAIN A). HOH(160, CHAIN A) HOH(429, CHAIN A). HOH(161, CHAIN A) HOH(430, CHAIN A). HOH(162, CHAIN A) HOH(431, CHAIN A). HOH(163, CHAIN A) HOH(432, CHAIN A). HOH(166, CHAIN A) HOH(433, CHAIN A). HOH(167, CHAIN A) HOH(434, CHAIN A). HOH(168, CHAIN A) HOH(435, CHAIN A). HOH(170, CHAIN A) HOH(436, CHAIN A). HOH(171, CHAIN A) HOH(437, CHAIN A). HOH(172, CHAIN A) HOH(438, CHAIN A). HOH(173, CHAIN A) HOH(439, CHAIN A). HOH(175, CHAIN A) HOH(440, CHAIN A). HOH(176, CHAIN A) HOH(441, CHAIN A). HOH(178, CHAIN A) HOH(442, CHAIN A). HOH(181, CHAIN A) HOH(443, CHAIN A). HOH(183, CHAIN A) HOH(444, CHAIN A). HOH(187, CHAIN A) HOH(445, CHAIN A). HOH(190, CHAIN A) HOH(446, CHAIN A). HOH(191, CHAIN A) HOH(447, CHAIN A). HOH(192, CHAIN A) HOH(448, CHAIN A). HOH(195, CHAIN A) HOH(449, CHAIN A). HOH(197, CHAIN A) HOH(450, CHAIN A). HOH(200, CHAIN A) HOH(451, CHAIN A). HOH(201, CHAIN A) HOH(452, CHAIN A). HOH(205, CHAIN A) HOH(453, CHAIN A). HOH(208, CHAIN A) HOH(454, CHAIN A). HOH(209, CHAIN A) HOH(455, CHAIN A). HOH(210, CHAIN A) HOH(456, CHAIN A). HOH(218, CHAIN A) HOH(457, CHAIN A). HOH(220, CHAIN A) HOH(458, CHAIN A). HOH(223, CHAIN A) HOH(459, CHAIN A). HOH(233, CHAIN A) HOH(460, CHAIN A). HOH(239, CHAIN A) HOH(461, CHAIN A). HOH(250, CHAIN A) HOH(462, CHAIN A). HOH(251, CHAIN A) HOH(463, CHAIN A). HOH(252, CHAIN A) HOH(464, CHAIN A). HOH(261, CHAIN A) HOH(465, CHAIN A). HOH(277, CHAIN A) HOH(466, CHAIN A).
解像度: 2→50 Å / Cor.coef. Fo:Fc: 0.95 / Cor.coef. Fo:Fc free: 0.944 / SU B: 3.308 / SU ML: 0.093 / 交差検証法: THROUGHOUT / ESU R: 0.188 / ESU R Free: 0.153 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
反射数
%反射
Selection details
Rfree
0.20713
403
4.7 %
RANDOM
Rwork
0.17565
-
-
-
all
0.17711
8577
-
-
obs
0.17711
8553
99.72 %
-
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