Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "69f9d16b28a6e95ddba61372b0db5e5c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.465,
"b": 62.424,
"c": 149.433,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [149.27,1.61],
"number_observations": 698326,
"number_observations_unique": 52537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.61],
"number_observations": 30846,
"number_observations_unique": 2460,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.777
},
{
"type": "R(meas)",
"value": 2.895
},
{
"type": "R(pim)",
"value": 0.814
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 12.5
},
{
"type": "CC(1/2)",
"value": 0.320
}
]
}
]
}