Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c60986a77c582eee01b3b79eee830cc7",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 90.70,
"b": 90.70,
"c": 120.63,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97240],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.130,1.700],
"number_observations": 127819,
"number_observations_unique": 52079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 7.100
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 6897,
"number_observations_unique": 2779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.552
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.571
}
]
},
{
"resolution_limits": [64.130,9.000],
"number_observations": 1076,
"number_observations_unique": 404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 17.400
},
{
"type": "Completeness",
"value": 91.400
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}