Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "25e2399d1c08ea796fdbe3cd4c9baceb",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 73.459,
"b": 73.459,
"c": 95.156,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.03321],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.58,3.50],
"number_observations_unique": 4021,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(meas)",
"value": 0.201
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 19.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [47.58,8.57],
"number_observations_unique": 310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "Redundancy",
"value": 16.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.83,3.50],
"number_observations_unique": 937,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.824
},
{
"type": "R(meas)",
"value": 1.912
},
{
"type": "R(pim)",
"value": 0.573
},
{
"type": "Redundancy",
"value": 20.5
},
{
"type": "CC(1/2)",
"value": 0.839
}
]
}
]
}