Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5da7dda5da813d4d493bee538a5c2d45",
"space_group_name": "P 1",
"unit_cell": {
"a": 45.60,
"b": 47.44,
"c": 58.45,
"alpha": 67.58,
"beta": 68.56,
"gamma": 69.02
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.410,1.830],
"number_observations": 62153,
"number_observations_unique": 34543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.195
},
{
"type": "R(pim)",
"value": 0.138
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.830],
"number_observations": 4693,
"number_observations_unique": 2543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.781
},
{
"type": "R(meas)",
"value": 1.104
},
{
"type": "R(pim)",
"value": 0.781
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.567
}
]
},
{
"resolution_limits": [42.410,8.180],
"number_observations": 787,
"number_observations_unique": 399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
}
]
}