Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d0ec9ef7099f505ef6d0650909d86aab",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 30.900,
"b": 81.594,
"c": 32.061,
"alpha": 90.00,
"beta": 117.84,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.594,1.220],
"number_observations": 130300,
"number_observations_unique": 39061,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 19.3
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.224,1.220],
"number_observations": 987,
"number_observations_unique": 330,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "Completeness",
"value": 76.900
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [81.594,5.662],
"number_observations": 1308,
"number_observations_unique": 403,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 91.600
},
{
"type": "Redundancy",
"value": 3.200
}
]
}
]
}