Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7dc1c403cc9335a08457e3400476e631",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 44.059,
"b": 44.059,
"c": 85.398,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.15,2.000],
"number_observations": 77578,
"number_observations_unique": 10680,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 12.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,2.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.682
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 7.500
}
]
},
{
"resolution_limits": [2.070,2.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.940
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 8.700
}
]
},
{
"resolution_limits": [2.110,2.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.997
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 9.700
}
]
},
{
"resolution_limits": [2.150,2.110],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.912
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 11.600
}
]
},
{
"resolution_limits": [2.200,2.150],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.745
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 12.700
}
]
},
{
"resolution_limits": [2.250,2.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.630
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 13.700
}
]
},
{
"resolution_limits": [2.310,2.250],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.572
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 14.200
}
]
},
{
"resolution_limits": [2.370,2.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.460
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 14.200
}
]
},
{
"resolution_limits": [2.440,2.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.356
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 14.200
}
]
},
{
"resolution_limits": [2.520,2.440],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 14.100
}
]
},
{
"resolution_limits": [2.610,2.520],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 14.000
}
]
},
{
"resolution_limits": [2.710,2.610],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.189
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 14.300
}
]
},
{
"resolution_limits": [2.840,2.710],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 13.900
}
]
},
{
"resolution_limits": [2.990,2.840],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 14.100
}
]
},
{
"resolution_limits": [3.170,2.990],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 13.600
}
]
},
{
"resolution_limits": [3.420,3.170],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 13.700
}
]
},
{
"resolution_limits": [3.760,3.420],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 13.700
}
]
},
{
"resolution_limits": [4.310,3.760],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 13.300
}
]
},
{
"resolution_limits": [5.430,4.310],
"quality_factors": [
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 12.900
}
]
},
{
"resolution_limits": [50.000,5.430],
"quality_factors": [
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 11.300
}
]
}
]
}