Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fc92b844a2fe8964072506bc888834f",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 69.335,
"b": 69.335,
"c": 169.063,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.950,1.690],
"number_observations": 989184,
"number_observations_unique": 52868,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 22.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 18.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.720,1.690],
"number_observations": 14134,
"number_observations_unique": 1831,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.140
},
{
"type": "R(meas)",
"value": 2.295
},
{
"type": "R(pim)",
"value": 0.781
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 68.700
},
{
"type": "Redundancy",
"value": 7.700
},
{
"type": "CC(1/2)",
"value": 0.113
}
]
},
{
"resolution_limits": [48.950,9.090],
"number_observations": 6624,
"number_observations_unique": 427,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 69.800
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 15.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}