Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d508a1da57ab87b1b9c2a1338f59c359",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 103.105,
"b": 103.105,
"c": 37.520,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97910,0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.650,2.030],
"number_observations": 303942,
"number_observations_unique": 15063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 16.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.080,2.030],
"number_observations": 21698,
"number_observations_unique": 1110,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.852
},
{
"type": "R(meas)",
"value": 1.901
},
{
"type": "R(pim)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.661
}
]
},
{
"resolution_limits": [44.650,9.080],
"number_observations": 3292,
"number_observations_unique": 189,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 57.600
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 17.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}