Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "716aaca398c61ca71c20cede11fcc691",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 140.3,
"b": 140.3,
"c": 94.8,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91970],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.894],
"number_observations_unique": 10809,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 8.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 9.200
}
]
},
"refln_shells": [
{
"resolution_limits": [3.000,2.900],
"number_observations_unique": 1052,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.493
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.700
}
]
},
{
"resolution_limits": [3.120,3.000],
"number_observations_unique": 1056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.354
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.600
}
]
},
{
"resolution_limits": [3.270,3.120],
"number_observations_unique": 1071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.256
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.600
}
]
},
{
"resolution_limits": [3.440,3.270],
"number_observations_unique": 1069,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.196
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.500
}
]
},
{
"resolution_limits": [3.650,3.440],
"number_observations_unique": 1060,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.500
}
]
},
{
"resolution_limits": [3.940,3.650],
"number_observations_unique": 1085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.200
}
]
},
{
"resolution_limits": [4.330,3.940],
"number_observations_unique": 1071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.900
}
]
},
{
"resolution_limits": [4.960,4.330],
"number_observations_unique": 1083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.700
}
]
},
{
"resolution_limits": [6.240,4.960],
"number_observations_unique": 1101,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 8.700
}
]
},
{
"resolution_limits": [50.000,6.240],
"number_observations_unique": 1161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 8.400
}
]
}
]
}