Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9ebc98985d57d6ddea17849c772bb584",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 30.282,
"b": 30.282,
"c": 118.330,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,2.440],
"number_observations_unique": 2642,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 17.480
},
{
"type": "Completeness",
"value": 99.500
}
]
},
"refln_shells": [
{
"resolution_limits": [2.590,2.440],
"number_observations": 5437,
"number_observations_unique": 404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.611
},
{
"type": "I/SigI",
"value": 4.010
},
{
"type": "Completeness",
"value": 97.300
}
]
},
{
"resolution_limits": [2.770,2.590],
"number_observations": 5829,
"number_observations_unique": 398,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.352
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.990,2.770],
"number_observations": 5067,
"number_observations_unique": 351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.256
},
{
"type": "I/SigI",
"value": 9.780
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.270,2.990],
"number_observations": 4732,
"number_observations_unique": 328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "I/SigI",
"value": 18.290
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.640,3.270],
"number_observations": 4258,
"number_observations_unique": 306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 25.430
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.190,3.640],
"number_observations": 3748,
"number_observations_unique": 281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 28.210
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [5.110,4.190],
"number_observations": 3277,
"number_observations_unique": 245,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 28.350
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [7.090,5.110],
"number_observations": 2459,
"number_observations_unique": 193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 29.500
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [30.0,7.090],
"number_observations": 1462,
"number_observations_unique": 136,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 28.820
},
{
"type": "Completeness",
"value": 99.300
}
]
}
]
}