Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d22cfd75577b77fd3efc64b0a2ff1169",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 91.827,
"b": 146.324,
"c": 418.866,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100.000,2.370],
"number_observations_unique": 204082,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.370],
"number_observations_unique": 20990,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.488
},
{
"type": "Completeness",
"value": 86.600
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
{
"resolution_limits": [2.580,2.460],
"number_observations_unique": 22531,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.450
},
{
"type": "Completeness",
"value": 93.400
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
{
"resolution_limits": [2.710,2.580],
"number_observations_unique": 21610,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.336
},
{
"type": "Completeness",
"value": 89.300
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
{
"resolution_limits": [2.880,2.710],
"number_observations_unique": 23798,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.247
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
{
"resolution_limits": [3.110,2.880],
"number_observations_unique": 23743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.192
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
{
"resolution_limits": [3.420,3.110],
"number_observations_unique": 22913,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
{
"resolution_limits": [3.910,3.420],
"number_observations_unique": 22828,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
{
"resolution_limits": [4.930,3.910],
"number_observations_unique": 23004,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 1.800
}
]
},
{
"resolution_limits": [100.000,4.930],
"number_observations_unique": 22665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 1.800
}
]
}
]
}