Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7979d87d54fe039f7e0669ccb308904b",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 90.473,
"b": 90.473,
"c": 106.955,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.206,2.070],
"number_observations": 296101,
"number_observations_unique": 57877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 17.060
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.190,2.070],
"number_observations": 47484,
"number_observations_unique": 9282,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.715
},
{
"type": "R(meas)",
"value": 1.913
},
{
"type": "I/SigI",
"value": 1.010
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "CC(1/2)",
"value": 0.774
}
]
},
{
"resolution_limits": [2.340,2.190],
"number_observations": 36842,
"number_observations_unique": 7578,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.759
},
{
"type": "R(meas)",
"value": 0.862
},
{
"type": "I/SigI",
"value": 1.750
},
{
"type": "Completeness",
"value": 83.100
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [2.530,2.340],
"number_observations": 42269,
"number_observations_unique": 8468,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.248
},
{
"type": "R(meas)",
"value": 0.278
},
{
"type": "I/SigI",
"value": 5.160
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 0.959
}
]
},
{
"resolution_limits": [2.770,2.530],
"number_observations": 42284,
"number_observations_unique": 7746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.173
},
{
"type": "R(meas)",
"value": 0.192
},
{
"type": "I/SigI",
"value": 7.880
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
{
"resolution_limits": [3.100,2.770],
"number_observations": 38433,
"number_observations_unique": 7090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 15.140
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [3.580,3.100],
"number_observations": 30424,
"number_observations_unique": 6214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 25.990
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.380,3.580],
"number_observations": 25242,
"number_observations_unique": 5206,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 41.790
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.180,4.380],
"number_observations": 21223,
"number_observations_unique": 4037,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 56.550
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [63.206,6.180],
"number_observations": 11897,
"number_observations_unique": 2253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 64.580
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}