Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "055b501ca682a9fd3d5bf37409c4f396",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.091,
"b": 49.966,
"c": 59.845,
"alpha": 90.00,
"beta": 95.51,
"gamma": 90.00
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.910,1.320],
"number_observations_unique": 54530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
"refln_shells": [
{
"resolution_limits": [1.340,1.320],
"number_observations": 8570,
"number_observations_unique": 2694,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.579
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [39.910,7.230],
"number_observations": 1116,
"number_observations_unique": 357,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 3.100
}
]
}
]
}