Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "46782da0bf90900053133ad26b6482ad",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 30.849,
"b": 81.845,
"c": 32.180,
"alpha": 90.00,
"beta": 117.85,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.923,1.200],
"number_observations": 135217,
"number_observations_unique": 43048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 19.7
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
"refln_shells": [
{
"resolution_limits": [1.204,1.200],
"number_observations": 853,
"number_observations_unique": 380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.205
},
{
"type": "Completeness",
"value": 81.900
},
{
"type": "Redundancy",
"value": 2.200
}
]
},
{
"resolution_limits": [40.923,5.565],
"number_observations": 1358,
"number_observations_unique": 440,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 3.100
}
]
}
]
}