Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "26feaa1c35b01832c70f289daa2f1865",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 75.53,
"b": 109.11,
"c": 118.40,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.690,2.000],
"number_observations": 447176,
"number_observations_unique": 66805,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 26815,
"number_observations_unique": 4451,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.191
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.593
}
]
},
{
"resolution_limits": [35.690,9.380],
"number_observations": 4287,
"number_observations_unique": 735,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 21.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}