Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6dff555084c3b2f5557331cba6ecce95",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 154.352,
"b": 114.513,
"c": 68.553,
"alpha": 90.00,
"beta": 95.64,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.500],
"number_observations_unique": 178912,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 15.300
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 4.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.550,1.500],
"number_observations_unique": 13588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.644
},
{
"type": "Completeness",
"value": 73.200
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [1.620,1.550],
"number_observations_unique": 17259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.538
},
{
"type": "Completeness",
"value": 92.800
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [1.690,1.620],
"number_observations_unique": 18235,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.436
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 4.100
}
]
},
{
"resolution_limits": [1.780,1.690],
"number_observations_unique": 18348,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.286
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [1.890,1.780],
"number_observations_unique": 18432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.187
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [2.040,1.890],
"number_observations_unique": 18474,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [2.240,2.040],
"number_observations_unique": 18501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [2.560,2.240],
"number_observations_unique": 18608,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [3.230,2.560],
"number_observations_unique": 18663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [50.000,3.230],
"number_observations_unique": 18804,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.200
}
]
}
]
}