Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2d9afd9c81bec2a2b878716e81544e22",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.603,
"b": 103.348,
"c": 86.597,
"alpha": 90.00,
"beta": 90.21,
"gamma": 90.00
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.38,2.700],
"number_observations_unique": 15791,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.203
},
{
"type": "R(pim)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Completeness",
"value": 91.2
},
{
"type": "Redundancy",
"value": 3.43
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.97,2.71],
"number_observations_unique": 790,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.543
},
{
"type": "R(meas)",
"value": 0.648
},
{
"type": "R(pim)",
"value": 0.351
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 51.4
},
{
"type": "Redundancy",
"value": 3.32
},
{
"type": "CC(1/2)",
"value": 0.757
}
]
}
]
}