Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f30448e710fcf1846b0dbe91c53d18f3",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.736,
"b": 42.736,
"c": 216.628,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.160,2.290],
"number_observations": 243094,
"number_observations_unique": 9910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.349
},
{
"type": "R(meas)",
"value": 0.356
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.500
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.290],
"number_observations": 33601,
"number_observations_unique": 1409,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.517
},
{
"type": "R(meas)",
"value": 3.595
},
{
"type": "R(pim)",
"value": 0.735
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 23.800
},
{
"type": "CC(1/2)",
"value": 0.873
}
]
},
{
"resolution_limits": [54.160,7.250],
"number_observations": 7174,
"number_observations_unique": 405,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 18.100
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 17.700
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}